Aniline and substituted anilines

Organic compounds that consist of a phenyl group attached to an amino group; aniline is the simplest aromatic amine. Anilines with additional substitutions are included.

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p-Anisidine, 99%

CAS: 104-94-9 Formula molecolare: C₇H₉NO Molecular Weight (g/mol): 123.15 Numero MDL: MFCD00007864 InChI Key: BHAAPTBBJKJZER-UHFFFAOYSA-N Sinonimo: p-anisidine,4-anisidine,4-methoxybenzenamine,4-aminoanisole,p-aminoanisole,para-anisidine,p-methoxyaniline,benzenamine, 4-methoxy,4-methoxybenzeneamine,p-anisylamine PubChem CID: 7732 ChEBI: CHEBI:82388 IUPAC Name: 4-methoxyaniline SMILES: COC1=CC=C(C=C1)N

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Sinonimo	p-anisidine,4-anisidine,4-methoxybenzenamine,4-aminoanisole,p-aminoanisole,para-anisidine,p-methoxyaniline,benzenamine, 4-methoxy,4-methoxybenzeneamine,p-anisylamine
Numero MDL	MFCD00007864
PubChem CID	7732
Formula molecolare	C₇H₉NO
CAS	104-94-9
Molecular Weight (g/mol)	123.15
ChEBI	CHEBI:82388
SMILES	COC1=CC=C(C=C1)N
IUPAC Name	4-methoxyaniline
InChI Key	BHAAPTBBJKJZER-UHFFFAOYSA-N

2-Bromoaniline, 98%

CAS: 615-36-1 Formula molecolare: C6H6BrN Molecular Weight (g/mol): 172.025 Numero MDL: MFCD00007632 InChI Key: AOPBDRUWRLBSDB-UHFFFAOYSA-N Sinonimo: o-bromoaniline,benzenamine, 2-bromo,o-aminobromobenzene,aniline, o-bromo,2-bromobenzenamine,bromoaniline 2-,2-bromo aniline,2-bromophenylamine,benzenamine,2-bromo,2-bromioaniline PubChem CID: 11992 IUPAC Name: 2-bromoaniline SMILES: C1=CC=C(C(=C1)N)Br

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Sinonimo	o-bromoaniline,benzenamine, 2-bromo,o-aminobromobenzene,aniline, o-bromo,2-bromobenzenamine,bromoaniline 2-,2-bromo aniline,2-bromophenylamine,benzenamine,2-bromo,2-bromioaniline
Numero MDL	MFCD00007632
PubChem CID	11992
Formula molecolare	C6H6BrN
CAS	615-36-1
Molecular Weight (g/mol)	172.025
SMILES	C1=CC=C(C(=C1)N)Br
IUPAC Name	2-bromoaniline
InChI Key	AOPBDRUWRLBSDB-UHFFFAOYSA-N

Thermo Scientific Chemicals Nitro Blue Tetrazolium Chloride, 90%

CAS: 298-83-9 Formula molecolare: C₄₀H₃₀Cl₂N₁₀O₆ Molecular Weight (g/mol): 817.65 InChI Key: FSVCQIDHPKZJSO-UHFFFAOYSA-L Sinonimo: nitrotetrazolium blue chloride,nitro bt,nitro blue tetrazolium,nbt,nitro blue tetrazolium chloride,p-nitrotetrazolium blue,nitrotetrazolium blue,nitroblue tetrazolium chloride,p-nitro blue tetrazolium chloride,nitro tetrazolium bt PubChem CID: 9281 ChEBI: CHEBI:9505 IUPAC Name: 2-[2-methoxy-4-[3-methoxy-4-[3-(4-nitrophenyl)-5-phenyltetrazol-2-ium-2-yl]phenyl]phenyl]-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;dichloride SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-]

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Sinonimo	nitrotetrazolium blue chloride,nitro bt,nitro blue tetrazolium,nbt,nitro blue tetrazolium chloride,p-nitrotetrazolium blue,nitrotetrazolium blue,nitroblue tetrazolium chloride,p-nitro blue tetrazolium chloride,nitro tetrazolium bt
PubChem CID	9281
Formula molecolare	C₄₀H₃₀Cl₂N₁₀O₆
CAS	298-83-9
Molecular Weight (g/mol)	817.65
ChEBI	CHEBI:9505
SMILES	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)[N+]3=NC(=NN3C4=CC=C(C=C4)[N+](=O)[O-])C5=CC=CC=C5)OC)[N+]6=NC(=NN6C7=CC=C(C=C7)[N+](=O)[O-])C8=CC=CC=C8.[Cl-].[Cl-]
IUPAC Name	2-[2-methoxy-4-[3-methoxy-4-[3-(4-nitrophenyl)-5-phenyltetrazol-2-ium-2-yl]phenyl]phenyl]-3-(4-nitrophenyl)-5-phenyltetrazol-2-ium;dichloride
InChI Key	FSVCQIDHPKZJSO-UHFFFAOYSA-L

3,3'-Dimethoxybenzidine, 97%

CAS: 119-90-4 Formula molecolare: C₁₄H₁₆N₂O₂ Molecular Weight (g/mol): 244.29 Numero MDL: MFCD00008372 InChI Key: JRBJSXQPQWSCCF-UHFFFAOYSA-N Sinonimo: 3,3'-dimethoxybenzidine,o-dianisidine,dianisidine,cellitazol b,neutrosel navy bn,diacel navy dc,disperse black 6,blue base nb,blue bn base,blue base irga b PubChem CID: 8411 ChEBI: CHEBI:82321 IUPAC Name: 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N

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Sinonimo	3,3'-dimethoxybenzidine,o-dianisidine,dianisidine,cellitazol b,neutrosel navy bn,diacel navy dc,disperse black 6,blue base nb,blue bn base,blue base irga b
Numero MDL	MFCD00008372
PubChem CID	8411
Formula molecolare	C₁₄H₁₆N₂O₂
CAS	119-90-4
Molecular Weight (g/mol)	244.29
ChEBI	CHEBI:82321
SMILES	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N
IUPAC Name	4-(4-amino-3-methoxyphenyl)-2-methoxyaniline
InChI Key	JRBJSXQPQWSCCF-UHFFFAOYSA-N

m-Anisidine, 98%

CAS: 536-90-3 Formula molecolare: C7H9NO Molecular Weight (g/mol): 123.155 Numero MDL: MFCD00007783 InChI Key: NCBZRJODKRCREW-UHFFFAOYSA-N Sinonimo: m-anisidine,3-aminoanisole,m-methoxyaniline,3-methoxybenzenamine,3-anisidine,m-aminoanisole,benzenamine, 3-methoxy,m-anisylamine,1-amino-3-methoxybenzene,unii-jxa144kx2i PubChem CID: 10824 IUPAC Name: 3-methoxyaniline SMILES: COC1=CC=CC(=C1)N

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Sinonimo	m-anisidine,3-aminoanisole,m-methoxyaniline,3-methoxybenzenamine,3-anisidine,m-aminoanisole,benzenamine, 3-methoxy,m-anisylamine,1-amino-3-methoxybenzene,unii-jxa144kx2i
Numero MDL	MFCD00007783
PubChem CID	10824
Formula molecolare	C7H9NO
CAS	536-90-3
Molecular Weight (g/mol)	123.155
SMILES	COC1=CC=CC(=C1)N
IUPAC Name	3-methoxyaniline
InChI Key	NCBZRJODKRCREW-UHFFFAOYSA-N

o-Dianisidine dihydrochloride, 98%

CAS: 20325-40-0 Formula molecolare: C14H18Cl2N2O2 Molecular Weight (g/mol): 317.21 Numero MDL: MFCD00012488 InChI Key: UXTIAFYTYOEQHV-UHFFFAOYSA-N Sinonimo: 3,3'-dimethoxybenzidine dihydrochloride,o-dianisidine dihydrochloride,3,3'-dimethoxy-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-qv96qa6ukk,dianisidine dihydrochloride,ccris 998,o-dianisidine hcl,qv96qa6ukk,c.i. disperse black 6 dihydrochloride PubChem CID: 62311 IUPAC Name: 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;dihydrochloride SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N.Cl.Cl

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Sinonimo	3,3'-dimethoxybenzidine dihydrochloride,o-dianisidine dihydrochloride,3,3'-dimethoxy-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-qv96qa6ukk,dianisidine dihydrochloride,ccris 998,o-dianisidine hcl,qv96qa6ukk,c.i. disperse black 6 dihydrochloride
Numero MDL	MFCD00012488
PubChem CID	62311
Formula molecolare	C14H18Cl2N2O2
CAS	20325-40-0
Molecular Weight (g/mol)	317.21
SMILES	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N.Cl.Cl
IUPAC Name	4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;dihydrochloride
InChI Key	UXTIAFYTYOEQHV-UHFFFAOYSA-N

4-Chloro-2,5-dimethoxyaniline, 98%

CAS: 6358-64-1 Formula molecolare: C8H10ClNO2 Molecular Weight (g/mol): 187.62 Numero MDL: MFCD00014893 InChI Key: YGUFQYGSBVXPMC-UHFFFAOYSA-N Sinonimo: 2,5-dimethoxy-4-chloroaniline,benzenamine, 4-chloro-2,5-dimethoxy,aniline, 4-chloro-2,5-dimethoxy,unii-t659iw8p4s,4-chloro-2,5-dimethoxyphenylamine,pubchem4366,acmc-1b2t2,dsstox_cid_20718,dsstox_rid_79565,dsstox_gsid_40718 PubChem CID: 22833 IUPAC Name: 4-chloro-2,5-dimethoxyaniline SMILES: COC1=CC(Cl)=C(OC)C=C1N

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Sinonimo	2,5-dimethoxy-4-chloroaniline,benzenamine, 4-chloro-2,5-dimethoxy,aniline, 4-chloro-2,5-dimethoxy,unii-t659iw8p4s,4-chloro-2,5-dimethoxyphenylamine,pubchem4366,acmc-1b2t2,dsstox_cid_20718,dsstox_rid_79565,dsstox_gsid_40718
Numero MDL	MFCD00014893
PubChem CID	22833
Formula molecolare	C8H10ClNO2
CAS	6358-64-1
Molecular Weight (g/mol)	187.62
SMILES	COC1=CC(Cl)=C(OC)C=C1N
IUPAC Name	4-chloro-2,5-dimethoxyaniline
InChI Key	YGUFQYGSBVXPMC-UHFFFAOYSA-N

p-Anisidine hydrochloride, 99%

CAS: 20265-97-8 Formula molecolare: C₇H₉NO·HCl Molecular Weight (g/mol): 159.61 Numero MDL: MFCD00036388 InChI Key: VQYJLACQFYZHCO-UHFFFAOYSA-N Sinonimo: p-anisidine hydrochloride,4-methoxyaniline hydrochloride,unii-7c4r75n8vg,benzenamine, 4-methoxy-, hydrochloride,p-anisidine.hcl,p-anisidine hcl,p-anisidinium chloride,4-anisidine hydrochloride,p-anisylamine hydrochloride,p-aminoanisole hydrochloride PubChem CID: 2734956 IUPAC Name: 4-methoxyaniline;hydrochloride SMILES: COC1=CC=C(C=C1)N.Cl

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Sinonimo	p-anisidine hydrochloride,4-methoxyaniline hydrochloride,unii-7c4r75n8vg,benzenamine, 4-methoxy-, hydrochloride,p-anisidine.hcl,p-anisidine hcl,p-anisidinium chloride,4-anisidine hydrochloride,p-anisylamine hydrochloride,p-aminoanisole hydrochloride
Numero MDL	MFCD00036388
PubChem CID	2734956
Formula molecolare	C₇H₉NO·HCl
CAS	20265-97-8
Molecular Weight (g/mol)	159.61
SMILES	COC1=CC=C(C=C1)N.Cl
IUPAC Name	4-methoxyaniline;hydrochloride
InChI Key	VQYJLACQFYZHCO-UHFFFAOYSA-N

2,5-Dimethoxyaniline, 99%

CAS: 102-56-7 Formula molecolare: C8H11NO2 Molecular Weight (g/mol): 153.18 Numero MDL: MFCD00008368 InChI Key: NAZDVUBIEPVUKE-UHFFFAOYSA-N Sinonimo: benzenamine, 2,5-dimethoxy,aminohydroquinone dimethyl ether,1-amino-2,5-dimethoxybenzene,2,5-dimethoxybenzenamine,aniline, 2,5-dimethoxy,unii-v3z5u3fl10,2,5 dimethoxyaniline,2,5-dimethoxyphenylamine,dimethoxyaniline 2,5-,2,5-dimethoxy aniline PubChem CID: 7613 IUPAC Name: 2,5-dimethoxyaniline SMILES: COC1=CC=C(OC)C(N)=C1

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Sinonimo	benzenamine, 2,5-dimethoxy,aminohydroquinone dimethyl ether,1-amino-2,5-dimethoxybenzene,2,5-dimethoxybenzenamine,aniline, 2,5-dimethoxy,unii-v3z5u3fl10,2,5 dimethoxyaniline,2,5-dimethoxyphenylamine,dimethoxyaniline 2,5-,2,5-dimethoxy aniline
Numero MDL	MFCD00008368
PubChem CID	7613
Formula molecolare	C8H11NO2
CAS	102-56-7
Molecular Weight (g/mol)	153.18
SMILES	COC1=CC=C(OC)C(N)=C1
IUPAC Name	2,5-dimethoxyaniline
InChI Key	NAZDVUBIEPVUKE-UHFFFAOYSA-N

3,3'-Dimethoxybenzidine dihydrochloride, 98%

CAS: 20325-40-0 Formula molecolare: C₁₄H₁₆N₂O₂·₂HCl Molecular Weight (g/mol): 317.21 Numero MDL: MFCD00012488 InChI Key: UXTIAFYTYOEQHV-UHFFFAOYSA-N Sinonimo: 3,3'-dimethoxybenzidine dihydrochloride,o-dianisidine dihydrochloride,3,3'-dimethoxy-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-qv96qa6ukk,dianisidine dihydrochloride,ccris 998,o-dianisidine hcl,qv96qa6ukk,c.i. disperse black 6 dihydrochloride PubChem CID: 62311 IUPAC Name: 4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;dihydrochloride SMILES: COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N.Cl.Cl

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Sinonimo	3,3'-dimethoxybenzidine dihydrochloride,o-dianisidine dihydrochloride,3,3'-dimethoxy-1,1'-biphenyl-4,4'-diamine dihydrochloride,unii-qv96qa6ukk,dianisidine dihydrochloride,ccris 998,o-dianisidine hcl,qv96qa6ukk,c.i. disperse black 6 dihydrochloride
Numero MDL	MFCD00012488
PubChem CID	62311
Formula molecolare	C₁₄H₁₆N₂O₂·₂HCl
CAS	20325-40-0
Molecular Weight (g/mol)	317.21
SMILES	COC1=C(C=CC(=C1)C2=CC(=C(C=C2)N)OC)N.Cl.Cl
IUPAC Name	4-(4-amino-3-methoxyphenyl)-2-methoxyaniline;dihydrochloride
InChI Key	UXTIAFYTYOEQHV-UHFFFAOYSA-N

4-Chloro-3-methoxyaniline, 98%

CAS: 13726-14-2 Formula molecolare: C7H8ClNO Molecular Weight (g/mol): 157.60 Numero MDL: MFCD00672967 InChI Key: LNKBDFVSILQKSI-UHFFFAOYSA-N Sinonimo: 3-methoxy-4-chloroaniline,4-chloro-3-methoxyphenylamine,4-chloro-m-anisidine,2-chloro-5-aminoanisole,5-amino-2-chloroanisole,4-chloro-3-methoxy aniline,4-chloro-3-methoxy-phenylamine,benzenamine, 4-chloro-3-methoxy,pubchem3659,acmc-1chua PubChem CID: 13103692 IUPAC Name: 4-chloro-3-methoxyaniline SMILES: COC1=C(Cl)C=CC(N)=C1

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Sinonimo	3-methoxy-4-chloroaniline,4-chloro-3-methoxyphenylamine,4-chloro-m-anisidine,2-chloro-5-aminoanisole,5-amino-2-chloroanisole,4-chloro-3-methoxy aniline,4-chloro-3-methoxy-phenylamine,benzenamine, 4-chloro-3-methoxy,pubchem3659,acmc-1chua
Numero MDL	MFCD00672967
PubChem CID	13103692
Formula molecolare	C7H8ClNO
CAS	13726-14-2
Molecular Weight (g/mol)	157.60
SMILES	COC1=C(Cl)C=CC(N)=C1
IUPAC Name	4-chloro-3-methoxyaniline
InChI Key	LNKBDFVSILQKSI-UHFFFAOYSA-N

3-Methoxyphenyl isocyanate, 99%

CAS: 18908-07-1 Formula molecolare: C8H7NO2 Molecular Weight (g/mol): 149.149 Numero MDL: MFCD00002019 InChI Key: NPOVTGVGOBJZPY-UHFFFAOYSA-N Sinonimo: 3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate PubChem CID: 87843 IUPAC Name: 1-isocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=O

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Sinonimo	3-methoxyphenyl isocyanate,benzene, 1-isocyanato-3-methoxy,isocyanic acid 3-methoxyphenyl ester,3-isocyanatoanisole,3-methoxyphenylisocyanate,m-methoxyphenyl isocyanate,1-isocyanato-3-methoxy-benzene,3-methoxybenzenisocyanate,m-anisyl isocyanate,m-methoxyphenylisocyanate
Numero MDL	MFCD00002019
PubChem CID	87843
Formula molecolare	C8H7NO2
CAS	18908-07-1
Molecular Weight (g/mol)	149.149
SMILES	COC1=CC=CC(=C1)N=C=O
IUPAC Name	1-isocyanato-3-methoxybenzene
InChI Key	NPOVTGVGOBJZPY-UHFFFAOYSA-N

2,6-Dibromoaniline, 97%, Thermo Scientific Chemicals

CAS: 608-30-0 Formula molecolare: C6H5Br2N Molecular Weight (g/mol): 250.92 Numero MDL: MFCD00007638 InChI Key: XIRRDAWDNHRRLB-UHFFFAOYSA-N Sinonimo: benzenamine, 2,6-dibromo,2,6-dibromophenylamine,2,6-dibromobenzenamine,aniline, 2,6-dibromo,2,6-dibromo-phenylamine,2,6-dibromo-aniline,acmc-1aycf,2,6-dibromoaniline,2,6-dibromo-phenyl-amine,ksc356c3l PubChem CID: 69098 IUPAC Name: 2,6-dibromoaniline SMILES: NC1=C(Br)C=CC=C1Br

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Sinonimo	benzenamine, 2,6-dibromo,2,6-dibromophenylamine,2,6-dibromobenzenamine,aniline, 2,6-dibromo,2,6-dibromo-phenylamine,2,6-dibromo-aniline,acmc-1aycf,2,6-dibromoaniline,2,6-dibromo-phenyl-amine,ksc356c3l
Numero MDL	MFCD00007638
PubChem CID	69098
Formula molecolare	C6H5Br2N
CAS	608-30-0
Molecular Weight (g/mol)	250.92
SMILES	NC1=C(Br)C=CC=C1Br
IUPAC Name	2,6-dibromoaniline
InChI Key	XIRRDAWDNHRRLB-UHFFFAOYSA-N

3-Methoxyphenyl isothiocyanate, 98%

CAS: 3125-64-2 Formula molecolare: C8H7NOS Molecular Weight (g/mol): 165.21 Numero MDL: MFCD00040335 InChI Key: WHBYCPUKGYEYFU-UHFFFAOYSA-N Sinonimo: 3-methoxyphenyl isothiocyanate,3-methoxyphenylisothiocyanate,1-isothiocyanato-3-methoxy-benzene,3-isothiocyanatoanisole,acmc-1cldj,m-methoxyphenyl isothiocyanate,3-methoxy phenyl isothiocyanate,3-methoxy-phenyl isothiocyanate,# PubChem CID: 137832 IUPAC Name: 1-isothiocyanato-3-methoxybenzene SMILES: COC1=CC=CC(=C1)N=C=S

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Sinonimo	3-methoxyphenyl isothiocyanate,3-methoxyphenylisothiocyanate,1-isothiocyanato-3-methoxy-benzene,3-isothiocyanatoanisole,acmc-1cldj,m-methoxyphenyl isothiocyanate,3-methoxy phenyl isothiocyanate,3-methoxy-phenyl isothiocyanate,#
Numero MDL	MFCD00040335
PubChem CID	137832
Formula molecolare	C8H7NOS
CAS	3125-64-2
Molecular Weight (g/mol)	165.21
SMILES	COC1=CC=CC(=C1)N=C=S
IUPAC Name	1-isothiocyanato-3-methoxybenzene
InChI Key	WHBYCPUKGYEYFU-UHFFFAOYSA-N

2-Methoxyphenyl isocyanate, 98%

CAS: 700-87-8 Formula molecolare: C8H7NO2 Molecular Weight (g/mol): 149.15 Numero MDL: MFCD00002004 InChI Key: SUVCZZADQDCIEQ-UHFFFAOYSA-N Sinonimo: 2-methoxyphenyl isocyanate,2-methoxyphenylisocyanate,benzene, 1-isocyanato-2-methoxy,o-methoxyphenyl isocyanate,2-isocyanatoanisole,1-isocyanato-2-methoxy-benzene,o-anisylisocyanate,2-methoxybenzenisocyanate,o-anisyl isocyanate,methoxyphenyl isocyanate PubChem CID: 69695 IUPAC Name: 1-isocyanato-2-methoxybenzene SMILES: COC1=CC=CC=C1N=C=O

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Sinonimo	2-methoxyphenyl isocyanate,2-methoxyphenylisocyanate,benzene, 1-isocyanato-2-methoxy,o-methoxyphenyl isocyanate,2-isocyanatoanisole,1-isocyanato-2-methoxy-benzene,o-anisylisocyanate,2-methoxybenzenisocyanate,o-anisyl isocyanate,methoxyphenyl isocyanate
Numero MDL	MFCD00002004
PubChem CID	69695
Formula molecolare	C8H7NO2
CAS	700-87-8
Molecular Weight (g/mol)	149.15
SMILES	COC1=CC=CC=C1N=C=O
IUPAC Name	1-isocyanato-2-methoxybenzene
InChI Key	SUVCZZADQDCIEQ-UHFFFAOYSA-N

Aniline and substituted anilines

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