Benzenoids
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Benzyl Alcohol, 99%, Pure
CAS: 100-51-6 Formula molecolare: C7H8O Molecular Weight (g/mol): 108.14 Numero MDL: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Sinonimo: benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol PubChem CID: 244 ChEBI: CHEBI:17987 IUPAC Name: phenylmethanol SMILES: OCC1=CC=CC=C1
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| Sinonimo | benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol |
|---|---|
| Numero MDL | MFCD00004599,MFCD03792087 |
| PubChem CID | 244 |
| Formula molecolare | C7H8O |
| CAS | 100-51-6 |
| Molecular Weight (g/mol) | 108.14 |
| ChEBI | CHEBI:17987 |
| SMILES | OCC1=CC=CC=C1 |
| IUPAC Name | phenylmethanol |
| InChI Key | WVDDGKGOMKODPV-UHFFFAOYSA-N |
Benzoic acid, 99.6%, ACS reagent
CAS: 65-85-0 Formula molecolare: C7H6O2 Molecular Weight (g/mol): 122.12 InChI Key: WPYMKLBDIGXBTP-UHFFFAOYSA-N Sinonimo: benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv PubChem CID: 243 ChEBI: CHEBI:30746 IUPAC Name: benzoic acid SMILES: C1=CC=C(C=C1)C(=O)O
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| Sinonimo | benzenecarboxylic acid,dracylic acid,benzeneformic acid,carboxybenzene,phenylformic acid,benzenemethanoic acid,phenylcarboxylic acid,retardex,benzoesaeure gk,benzoesaeure gv |
|---|---|
| PubChem CID | 243 |
| Formula molecolare | C7H6O2 |
| CAS | 65-85-0 |
| Molecular Weight (g/mol) | 122.12 |
| ChEBI | CHEBI:30746 |
| SMILES | C1=CC=C(C=C1)C(=O)O |
| IUPAC Name | benzoic acid |
| InChI Key | WPYMKLBDIGXBTP-UHFFFAOYSA-N |
Guaiacol, 99+%
CAS: 90-05-1 Formula molecolare: C7H8O2 Molecular Weight (g/mol): 124.14 InChI Key: LHGVFZTZFXWLCP-UHFFFAOYSA-N Sinonimo: guaiacol,o-methoxyphenol,2-hydroxyanisole,phenol, 2-methoxy,pyrocatechol monomethyl ether,methylcatechol,guaiastil,guaicol,1-hydroxy-2-methoxybenzene,pyroguaiac acid PubChem CID: 460 ChEBI: CHEBI:28591 IUPAC Name: 2-methoxyphenol SMILES: COC1=CC=CC=C1O
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| Sinonimo | guaiacol,o-methoxyphenol,2-hydroxyanisole,phenol, 2-methoxy,pyrocatechol monomethyl ether,methylcatechol,guaiastil,guaicol,1-hydroxy-2-methoxybenzene,pyroguaiac acid |
|---|---|
| PubChem CID | 460 |
| Formula molecolare | C7H8O2 |
| CAS | 90-05-1 |
| Molecular Weight (g/mol) | 124.14 |
| ChEBI | CHEBI:28591 |
| SMILES | COC1=CC=CC=C1O |
| IUPAC Name | 2-methoxyphenol |
| InChI Key | LHGVFZTZFXWLCP-UHFFFAOYSA-N |
Styrene, 99%, extra pure, stabilized
CAS: 100-42-5 Formula molecolare: C8H8 Molecular Weight (g/mol): 104.15 Numero MDL: MFCD00008612,MFCD00084450 InChI Key: PPBRXRYQALVLMV-UHFFFAOYSA-N Sinonimo: ethenylbenzene,phenylethylene,vinylbenzene,styrol,benzene, ethenyl,cinnamene,phenylethene,monomer,phenethylene,styrolene PubChem CID: 7501 ChEBI: CHEBI:27452 IUPAC Name: stirene SMILES: C=CC1=CC=CC=C1
| Sinonimo | ethenylbenzene,phenylethylene,vinylbenzene,styrol,benzene, ethenyl,cinnamene,phenylethene,monomer,phenethylene,styrolene |
|---|---|
| Numero MDL | MFCD00008612,MFCD00084450 |
| PubChem CID | 7501 |
| Formula molecolare | C8H8 |
| CAS | 100-42-5 |
| Molecular Weight (g/mol) | 104.15 |
| ChEBI | CHEBI:27452 |
| SMILES | C=CC1=CC=CC=C1 |
| IUPAC Name | stirene |
| InChI Key | PPBRXRYQALVLMV-UHFFFAOYSA-N |
Benzophenone, 99%
CAS: 119-61-9 Formula molecolare: C13H10O Molecular Weight (g/mol): 182.222 Numero MDL: MFCD00003076 InChI Key: RWCCWEUUXYIKHB-UHFFFAOYSA-N Sinonimo: benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone PubChem CID: 3102 ChEBI: CHEBI:41308 IUPAC Name: diphenylmethanone SMILES: C1=CC=C(C=C1)C(=O)C2=CC=CC=C2
| Sinonimo | benzophenone,diphenyl ketone,benzoylbenzene,phenyl ketone,methanone, diphenyl,alpha-oxoditane,ketone, diphenyl,benzene, benzoyl,alpha-oxodiphenylmethane,diphenylketone |
|---|---|
| Numero MDL | MFCD00003076 |
| PubChem CID | 3102 |
| Formula molecolare | C13H10O |
| CAS | 119-61-9 |
| Molecular Weight (g/mol) | 182.222 |
| ChEBI | CHEBI:41308 |
| SMILES | C1=CC=C(C=C1)C(=O)C2=CC=CC=C2 |
| IUPAC Name | diphenylmethanone |
| InChI Key | RWCCWEUUXYIKHB-UHFFFAOYSA-N |
1,3,5-Trimethoxybenzene, 99%
CAS: 621-23-8 Formula molecolare: C9H12O3 Molecular Weight (g/mol): 168.19 Numero MDL: MFCD00008385 InChI Key: LKUDPHPHKOZXCD-UHFFFAOYSA-N Sinonimo: phloroglucinol trimethyl ether,sym-trimethoxybenzene,benzene, 1,3,5-trimethoxy,1,3,5-trimethyoxybenzene,unii-00vji3vg3d,1,3,5-trimethoxy benzene,o,o,o-1,3,5-trimethylresorcinol,00vji3vg3d,dsstox_cid_25963,dsstox_rid_81259 PubChem CID: 69301 ChEBI: CHEBI:31038 IUPAC Name: 1,3,5-trimethoxybenzene SMILES: COC1=CC(OC)=CC(OC)=C1
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| Sinonimo | phloroglucinol trimethyl ether,sym-trimethoxybenzene,benzene, 1,3,5-trimethoxy,1,3,5-trimethyoxybenzene,unii-00vji3vg3d,1,3,5-trimethoxy benzene,o,o,o-1,3,5-trimethylresorcinol,00vji3vg3d,dsstox_cid_25963,dsstox_rid_81259 |
|---|---|
| Numero MDL | MFCD00008385 |
| PubChem CID | 69301 |
| Formula molecolare | C9H12O3 |
| CAS | 621-23-8 |
| Molecular Weight (g/mol) | 168.19 |
| ChEBI | CHEBI:31038 |
| SMILES | COC1=CC(OC)=CC(OC)=C1 |
| IUPAC Name | 1,3,5-trimethoxybenzene |
| InChI Key | LKUDPHPHKOZXCD-UHFFFAOYSA-N |
2-Phenoxyethanol, 99%
CAS: 122-99-6 Formula molecolare: C8H10O2 Molecular Weight (g/mol): 138.17 Numero MDL: MFCD00002857 InChI Key: QCDWFXQBSFUVSP-UHFFFAOYSA-N Sinonimo: phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane PubChem CID: 31236 ChEBI: CHEBI:64275 IUPAC Name: 2-phenoxyethanol SMILES: C1=CC=C(C=C1)OCCO
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| Sinonimo | phenoxyethanol,ethylene glycol monophenyl ether,phenyl cellosolve,ethanol, 2-phenoxy,phenoxytol,phenoxethol,phenoxetol,ethylene glycol phenyl ether,phenoxyethyl alcohol,1-hydroxy-2-phenoxyethane |
|---|---|
| Numero MDL | MFCD00002857 |
| PubChem CID | 31236 |
| Formula molecolare | C8H10O2 |
| CAS | 122-99-6 |
| Molecular Weight (g/mol) | 138.17 |
| ChEBI | CHEBI:64275 |
| SMILES | C1=CC=C(C=C1)OCCO |
| IUPAC Name | 2-phenoxyethanol |
| InChI Key | QCDWFXQBSFUVSP-UHFFFAOYSA-N |
Methylene di-p-phenyl diisocyanate, 98%, flakes
CAS: 101-68-8 Formula molecolare: C15H10N2O2 Molecular Weight (g/mol): 250.26 Numero MDL: MFCD00036131 InChI Key: UPMLOUAZCHDJJD-UHFFFAOYSA-N Sinonimo: 4,4'-diphenylmethane diisocyanate,diphenylmethane diisocyanate,isonate,4,4'-diisocyanatodiphenylmethane,p,p'-diphenylmethane diisocyanate,bis 4-isocyanatophenyl methane,4,4'-methylenebis phenyl isocyanate,methylbisphenyl isocyanate,1,1'-methylenebis 4-isocyanatobenzene,methylene diphenyl diisocyanate PubChem CID: 7570 ChEBI: CHEBI:53218 IUPAC Name: 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene SMILES: C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O
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| Sinonimo | 4,4'-diphenylmethane diisocyanate,diphenylmethane diisocyanate,isonate,4,4'-diisocyanatodiphenylmethane,p,p'-diphenylmethane diisocyanate,bis 4-isocyanatophenyl methane,4,4'-methylenebis phenyl isocyanate,methylbisphenyl isocyanate,1,1'-methylenebis 4-isocyanatobenzene,methylene diphenyl diisocyanate |
|---|---|
| Numero MDL | MFCD00036131 |
| PubChem CID | 7570 |
| Formula molecolare | C15H10N2O2 |
| CAS | 101-68-8 |
| Molecular Weight (g/mol) | 250.26 |
| ChEBI | CHEBI:53218 |
| SMILES | C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O |
| IUPAC Name | 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene |
| InChI Key | UPMLOUAZCHDJJD-UHFFFAOYSA-N |
4-Aminobenzoic acid, 99%
CAS: 150-13-0 Formula molecolare: C7H7NO2 Molecular Weight (g/mol): 137.14 Numero MDL: MFCD00007894 InChI Key: ALYNCZNDIQEVRV-UHFFFAOYSA-N Sinonimo: p-aminobenzoic acid,paba,para-aminobenzoic acid,vitamin bx,sunbrella,p-carboxyaniline,4-carboxyaniline,hachemina,paraminol,benzoic acid, 4-amino PubChem CID: 978 ChEBI: CHEBI:30753 IUPAC Name: 4-aminobenzoic acid SMILES: NC1=CC=C(C=C1)C(O)=O
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| Sinonimo | p-aminobenzoic acid,paba,para-aminobenzoic acid,vitamin bx,sunbrella,p-carboxyaniline,4-carboxyaniline,hachemina,paraminol,benzoic acid, 4-amino |
|---|---|
| Numero MDL | MFCD00007894 |
| PubChem CID | 978 |
| Formula molecolare | C7H7NO2 |
| CAS | 150-13-0 |
| Molecular Weight (g/mol) | 137.14 |
| ChEBI | CHEBI:30753 |
| SMILES | NC1=CC=C(C=C1)C(O)=O |
| IUPAC Name | 4-aminobenzoic acid |
| InChI Key | ALYNCZNDIQEVRV-UHFFFAOYSA-N |
4-Acetamidophenol, 98%
CAS: 103-90-2 Formula molecolare: C8H9NO2 Molecular Weight (g/mol): 151.17 Numero MDL: MFCD00002328 InChI Key: RZVAJINKPMORJF-UHFFFAOYSA-N Sinonimo: acetaminophen,4-acetamidophenol,paracetamol,apap,n-4-hydroxyphenyl acetamide,tylenol,acetaminofen,panadol,datril,p-acetamidophenol PubChem CID: 1983 ChEBI: CHEBI:46195 IUPAC Name: N-(4-hydroxyphenyl)acetamide SMILES: CC(=O)NC1=CC=C(O)C=C1
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| Sinonimo | acetaminophen,4-acetamidophenol,paracetamol,apap,n-4-hydroxyphenyl acetamide,tylenol,acetaminofen,panadol,datril,p-acetamidophenol |
|---|---|
| Numero MDL | MFCD00002328 |
| PubChem CID | 1983 |
| Formula molecolare | C8H9NO2 |
| CAS | 103-90-2 |
| Molecular Weight (g/mol) | 151.17 |
| ChEBI | CHEBI:46195 |
| SMILES | CC(=O)NC1=CC=C(O)C=C1 |
| IUPAC Name | N-(4-hydroxyphenyl)acetamide |
| InChI Key | RZVAJINKPMORJF-UHFFFAOYSA-N |
Thermo Scientific Chemicals Basic Fuchsin
CAS: 632-99-5 Formula molecolare: C20H20ClN3 Molecular Weight (g/mol): 337.85 Numero MDL: MFCD00012569 InChI Key: AXDJCCTWPBKUKL-UHFFFAOYSA-N Sinonimo: basic violet 14,fuchsin,fuchsin basic,magenta,rosaniline,fuchsine,basic fuchsine,basic magenta,rose aniline,fuchsin, basic PubChem CID: 12447 IUPAC Name: 4-[(4-aminophenyl)-(4-imino-3-methylcyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride SMILES: [H+].[Cl-].CC1=CC(C=CC1=N)=C(C1=CC=C(N)C=C1)C1=CC=C(N)C=C1
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| Sinonimo | basic violet 14,fuchsin,fuchsin basic,magenta,rosaniline,fuchsine,basic fuchsine,basic magenta,rose aniline,fuchsin, basic |
|---|---|
| Numero MDL | MFCD00012569 |
| PubChem CID | 12447 |
| Formula molecolare | C20H20ClN3 |
| CAS | 632-99-5 |
| Molecular Weight (g/mol) | 337.85 |
| SMILES | [H+].[Cl-].CC1=CC(C=CC1=N)=C(C1=CC=C(N)C=C1)C1=CC=C(N)C=C1 |
| IUPAC Name | 4-[(4-aminophenyl)-(4-imino-3-methylcyclohexa-2,5-dien-1-ylidene)methyl]aniline;hydrochloride |
| InChI Key | AXDJCCTWPBKUKL-UHFFFAOYSA-N |
4-Methoxyphenol, 99%
CAS: 150-76-5 Formula molecolare: C7H8O2 Molecular Weight (g/mol): 124.14 Numero MDL: MFCD00002332 InChI Key: NWVVVBRKAWDGAB-UHFFFAOYSA-N Sinonimo: mequinol,4-hydroxyanisole,p-hydroxyanisole,p-methoxyphenol,hydroquinone monomethyl ether,phenol, 4-methoxy,leucobasal,mehq,leucodine b,mechinolum PubChem CID: 9015 ChEBI: CHEBI:69441 IUPAC Name: 4-methoxyphenol SMILES: COC1=CC=C(O)C=C1
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| Sinonimo | mequinol,4-hydroxyanisole,p-hydroxyanisole,p-methoxyphenol,hydroquinone monomethyl ether,phenol, 4-methoxy,leucobasal,mehq,leucodine b,mechinolum |
|---|---|
| Numero MDL | MFCD00002332 |
| PubChem CID | 9015 |
| Formula molecolare | C7H8O2 |
| CAS | 150-76-5 |
| Molecular Weight (g/mol) | 124.14 |
| ChEBI | CHEBI:69441 |
| SMILES | COC1=CC=C(O)C=C1 |
| IUPAC Name | 4-methoxyphenol |
| InChI Key | NWVVVBRKAWDGAB-UHFFFAOYSA-N |
Salicylic acid, sodium salt, 99+%, Thermo Scientific Chemicals
CAS: 54-21-7 Formula molecolare: C7H5NaO3 Molecular Weight (g/mol): 160.104 Numero MDL: MFCD00002440 InChI Key: ABBQHOQBGMUPJH-UHFFFAOYSA-M Sinonimo: sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl PubChem CID: 16760658 ChEBI: CHEBI:9180 IUPAC Name: sodium;2-hydroxybenzoate SMILES: C1=CC=C(C(=C1)C(=O)[O-])O.[Na+]
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| Sinonimo | sodium salicylate,sodium 2-hydroxybenzoate,salsonin,clin,enterosalicyl,enterosalil,entrosalyl,glutosalyl,kerasalicyl,magsalyl |
|---|---|
| Numero MDL | MFCD00002440 |
| PubChem CID | 16760658 |
| Formula molecolare | C7H5NaO3 |
| CAS | 54-21-7 |
| Molecular Weight (g/mol) | 160.104 |
| ChEBI | CHEBI:9180 |
| SMILES | C1=CC=C(C(=C1)C(=O)[O-])O.[Na+] |
| IUPAC Name | sodium;2-hydroxybenzoate |
| InChI Key | ABBQHOQBGMUPJH-UHFFFAOYSA-M |
DAPT
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p-Toluenesulfonyl isocyanate, 96%
CAS: 4083-64-1 Formula molecolare: C8H7NO3S Molecular Weight (g/mol): 197.21 Numero MDL: MFCD00002030 InChI Key: VLJQDHDVZJXNQL-UHFFFAOYSA-N Sinonimo: tosyl isocyanate,p-toluenesulfonyl isocyanate,4-methylbenzenesulfonyl isocyanate,p-toluenesulphonyl isocyanate,benzenesulfonyl isocyanate, 4-methyl,tosylisocyanate,p-tolylsulfonyl isocyanate,unii-h9004fjx6v,p-toluenesulfonic acid, anhydride with isocyanic acid,p-toluene sulfonyl isocyanate PubChem CID: 77703 IUPAC Name: 4-methyl-N-(oxomethylidene)benzenesulfonamide SMILES: CC1=CC=C(C=C1)S(=O)(=O)N=C=O
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| Sinonimo | tosyl isocyanate,p-toluenesulfonyl isocyanate,4-methylbenzenesulfonyl isocyanate,p-toluenesulphonyl isocyanate,benzenesulfonyl isocyanate, 4-methyl,tosylisocyanate,p-tolylsulfonyl isocyanate,unii-h9004fjx6v,p-toluenesulfonic acid, anhydride with isocyanic acid,p-toluene sulfonyl isocyanate |
|---|---|
| Numero MDL | MFCD00002030 |
| PubChem CID | 77703 |
| Formula molecolare | C8H7NO3S |
| CAS | 4083-64-1 |
| Molecular Weight (g/mol) | 197.21 |
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)N=C=O |
| IUPAC Name | 4-methyl-N-(oxomethylidene)benzenesulfonamide |
| InChI Key | VLJQDHDVZJXNQL-UHFFFAOYSA-N |