Benzene and substituted derivatives
Filtered Search Results
2-Methoxy-4-nitrophenyl isothiocyanate, 97%
CAS: 190774-55-1 Molecular Formula: C8H6N2O3S Molecular Weight (g/mol): 210.207 MDL Number: MFCD00041379 InChI Key: NXWXXLFRMVILJN-UHFFFAOYSA-N Synonym: 2-methoxy-4-nitrophenyl isothiocyanate,1-isothiocyanato-2-methoxy-4-nitro-benzene,acmc-20ans0,2-methoxy4-nitrophenyl isothiocyanate,2-methoxy-4-nitrophenylisothiocyanate,#,benzene, 1-isothiocyanato-2-methoxy-4-nitro,benzene, 1-isothiocyanato-2-methoxy-4-nitro-9ci PubChem CID: 610837 IUPAC Name: 1-isothiocyanato-2-methoxy-4-nitrobenzene SMILES: COC1=C(C=CC(=C1)[N+](=O)[O-])N=C=S
| PubChem CID | 610837 |
|---|---|
| CAS | 190774-55-1 |
| Molecular Weight (g/mol) | 210.207 |
| MDL Number | MFCD00041379 |
| SMILES | COC1=C(C=CC(=C1)[N+](=O)[O-])N=C=S |
| Synonym | 2-methoxy-4-nitrophenyl isothiocyanate,1-isothiocyanato-2-methoxy-4-nitro-benzene,acmc-20ans0,2-methoxy4-nitrophenyl isothiocyanate,2-methoxy-4-nitrophenylisothiocyanate,#,benzene, 1-isothiocyanato-2-methoxy-4-nitro,benzene, 1-isothiocyanato-2-methoxy-4-nitro-9ci |
| IUPAC Name | 1-isothiocyanato-2-methoxy-4-nitrobenzene |
| InChI Key | NXWXXLFRMVILJN-UHFFFAOYSA-N |
| Molecular Formula | C8H6N2O3S |
3,3'-Diaminodiphenyl sulfone, 98%
CAS: 599-61-1 Molecular Formula: C12H12N2O2S Molecular Weight (g/mol): 248.30 MDL Number: MFCD00007792 InChI Key: LJGHYPLBDBRCRZ-UHFFFAOYSA-N Synonym: 3,3'-sulfonyldianiline,3,3'-diaminodiphenyl sulfone,3-aminophenyl sulfone,benzenamine, 3,3'-sulfonylbis,3,3'-sulphonyldianiline,bis m-aminophenyl sulfone,3-aminophenyl-sulfone,3,3'-diaminophenyl sulfone,3,3'-sulfonylbis aniline,sulfone, bis m-aminophenyl PubChem CID: 11741 IUPAC Name: 3-(3-aminophenyl)sulfonylaniline SMILES: NC1=CC(=CC=C1)S(=O)(=O)C1=CC(N)=CC=C1
| PubChem CID | 11741 |
|---|---|
| CAS | 599-61-1 |
| Molecular Weight (g/mol) | 248.30 |
| MDL Number | MFCD00007792 |
| SMILES | NC1=CC(=CC=C1)S(=O)(=O)C1=CC(N)=CC=C1 |
| Synonym | 3,3'-sulfonyldianiline,3,3'-diaminodiphenyl sulfone,3-aminophenyl sulfone,benzenamine, 3,3'-sulfonylbis,3,3'-sulphonyldianiline,bis m-aminophenyl sulfone,3-aminophenyl-sulfone,3,3'-diaminophenyl sulfone,3,3'-sulfonylbis aniline,sulfone, bis m-aminophenyl |
| IUPAC Name | 3-(3-aminophenyl)sulfonylaniline |
| InChI Key | LJGHYPLBDBRCRZ-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O2S |
4-Acetamidobenzenesulfonyl azide, 97%
CAS: 2158-14-7 Molecular Formula: C8H8N4O3S Molecular Weight (g/mol): 240.24 MDL Number: MFCD00029626 InChI Key: NTMHWRHEGDRTPD-UHFFFAOYSA-N Synonym: 4-acetamidobenzenesulfonyl azide,p-absa,n-4-azidosulfonylphenyl acetamide,4-acetamidobenzenesulfonylazide,4-acetamidobenzenesulphonyl azide,4-acetamidobenzene sulfonyl azide,4-acetamidobenzene-1-sulfonyl azide,acmc-1chyo,ksc491c8r,p-acetamidobenzensulfonyl azide PubChem CID: 5129185 IUPAC Name: N-(4-azidosulfonylphenyl)acetamide SMILES: CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N=[N+]=[N-]
| PubChem CID | 5129185 |
|---|---|
| CAS | 2158-14-7 |
| Molecular Weight (g/mol) | 240.24 |
| MDL Number | MFCD00029626 |
| SMILES | CC(=O)NC1=CC=C(C=C1)S(=O)(=O)N=[N+]=[N-] |
| Synonym | 4-acetamidobenzenesulfonyl azide,p-absa,n-4-azidosulfonylphenyl acetamide,4-acetamidobenzenesulfonylazide,4-acetamidobenzenesulphonyl azide,4-acetamidobenzene sulfonyl azide,4-acetamidobenzene-1-sulfonyl azide,acmc-1chyo,ksc491c8r,p-acetamidobenzensulfonyl azide |
| IUPAC Name | N-(4-azidosulfonylphenyl)acetamide |
| InChI Key | NTMHWRHEGDRTPD-UHFFFAOYSA-N |
| Molecular Formula | C8H8N4O3S |
1-(4-Methoxyphenyl)-5-methyl-1H-pyrazole-4-carboxylic acid, 97%, Thermo Scientific™
CAS: 187998-64-7 Molecular Formula: C12H12N2O3 Molecular Weight (g/mol): 232.239 MDL Number: MFCD02677745 InChI Key: JPFGKGZYCXLEGQ-UHFFFAOYSA-N PubChem CID: 2776133 IUPAC Name: 1-(4-methoxyphenyl)-5-methylpyrazole-4-carboxylic acid SMILES: CC1=C(C=NN1C2=CC=C(C=C2)OC)C(=O)O
| PubChem CID | 2776133 |
|---|---|
| CAS | 187998-64-7 |
| Molecular Weight (g/mol) | 232.239 |
| MDL Number | MFCD02677745 |
| SMILES | CC1=C(C=NN1C2=CC=C(C=C2)OC)C(=O)O |
| IUPAC Name | 1-(4-methoxyphenyl)-5-methylpyrazole-4-carboxylic acid |
| InChI Key | JPFGKGZYCXLEGQ-UHFFFAOYSA-N |
| Molecular Formula | C12H12N2O3 |
Methyl 2-chloro-4-nitrobenzoate, 98%, Thermo Scientific™
CAS: 13324-11-3 Molecular Formula: C8H6ClNO4 Molecular Weight (g/mol): 215.59 MDL Number: MFCD00017013 InChI Key: PICNSXCJRMYANX-UHFFFAOYSA-N Synonym: 2-chloro-4-nitrobenzoic acid methyl ester,methyl2-chloro-4-nitrobenzoate,4-nitro-2-chlorobenzoic acid methyl ester,2-chloro-4-nitro-benzoic acid methyl ester,benzoic acid, 2-chloro-4-nitro-, methyl ester,maybridge1_005088,acmc-1c12v,methyl-2-chloro-4-nitrobenzoate,methyl-4-nitro-2-chlorobenzoate,2-chloro-4-nitrobenzoic acid methylester PubChem CID: 83343 IUPAC Name: methyl 2-chloro-4-nitrobenzoate SMILES: COC(=O)C1=CC=C(C=C1Cl)[N+]([O-])=O
| PubChem CID | 83343 |
|---|---|
| CAS | 13324-11-3 |
| Molecular Weight (g/mol) | 215.59 |
| MDL Number | MFCD00017013 |
| SMILES | COC(=O)C1=CC=C(C=C1Cl)[N+]([O-])=O |
| Synonym | 2-chloro-4-nitrobenzoic acid methyl ester,methyl2-chloro-4-nitrobenzoate,4-nitro-2-chlorobenzoic acid methyl ester,2-chloro-4-nitro-benzoic acid methyl ester,benzoic acid, 2-chloro-4-nitro-, methyl ester,maybridge1_005088,acmc-1c12v,methyl-2-chloro-4-nitrobenzoate,methyl-4-nitro-2-chlorobenzoate,2-chloro-4-nitrobenzoic acid methylester |
| IUPAC Name | methyl 2-chloro-4-nitrobenzoate |
| InChI Key | PICNSXCJRMYANX-UHFFFAOYSA-N |
| Molecular Formula | C8H6ClNO4 |
3-Chloro-2-methylanisole, 97%
CAS: 3260-88-6 Molecular Formula: C8H9ClO Molecular Weight (g/mol): 156.61 MDL Number: MFCD00070772 InChI Key: LTVRGAWOEOKGJZ-UHFFFAOYSA-N Synonym: 3-chloro-2-methylanisole,2-methyl-3-chloroanisole,2-chloro-6-methoxytoluene,benzene, 1-chloro-3-methoxy-2-methyl,2-methoxy-6-chlorotoluene,1-chloro-3-methoxy-2-methyl-benzene,pubchem2664,acmc-1cq3o,ltvrgawoeokgjz-uhfffaoysa PubChem CID: 76749 IUPAC Name: 1-chloro-3-methoxy-2-methylbenzene SMILES: COC1=CC=CC(Cl)=C1C
| PubChem CID | 76749 |
|---|---|
| CAS | 3260-88-6 |
| Molecular Weight (g/mol) | 156.61 |
| MDL Number | MFCD00070772 |
| SMILES | COC1=CC=CC(Cl)=C1C |
| Synonym | 3-chloro-2-methylanisole,2-methyl-3-chloroanisole,2-chloro-6-methoxytoluene,benzene, 1-chloro-3-methoxy-2-methyl,2-methoxy-6-chlorotoluene,1-chloro-3-methoxy-2-methyl-benzene,pubchem2664,acmc-1cq3o,ltvrgawoeokgjz-uhfffaoysa |
| IUPAC Name | 1-chloro-3-methoxy-2-methylbenzene |
| InChI Key | LTVRGAWOEOKGJZ-UHFFFAOYSA-N |
| Molecular Formula | C8H9ClO |
2,4-Difluorobenzoic acid, 98%
CAS: 1583-58-0 Molecular Formula: C7H4F2O2 Molecular Weight (g/mol): 158.10 MDL Number: MFCD00011670 InChI Key: NJYBIFYEWYWYAN-UHFFFAOYSA-N Synonym: 2,4-dfba,benzoic acid, 2,4-difluoro,2,4-difluorobenzoicacid,2,4-difluoro-benzoic acid,zlchem 472,pubchem1336,acmc-1brgf,2,4-difluorbenzoic acid,2,4-difluorobezoic acid,2 4-difluorobenzoic acid PubChem CID: 74102 IUPAC Name: 2,4-difluorobenzoic acid SMILES: OC(=O)C1=CC=C(F)C=C1F
| PubChem CID | 74102 |
|---|---|
| CAS | 1583-58-0 |
| Molecular Weight (g/mol) | 158.10 |
| MDL Number | MFCD00011670 |
| SMILES | OC(=O)C1=CC=C(F)C=C1F |
| Synonym | 2,4-dfba,benzoic acid, 2,4-difluoro,2,4-difluorobenzoicacid,2,4-difluoro-benzoic acid,zlchem 472,pubchem1336,acmc-1brgf,2,4-difluorbenzoic acid,2,4-difluorobezoic acid,2 4-difluorobenzoic acid |
| IUPAC Name | 2,4-difluorobenzoic acid |
| InChI Key | NJYBIFYEWYWYAN-UHFFFAOYSA-N |
| Molecular Formula | C7H4F2O2 |
4-Biphenylcarboxylic acid, 98%
CAS: 92-92-2 Molecular Formula: C13H10O2 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00002553 InChI Key: NNJMFJSKMRYHSR-UHFFFAOYSA-N Synonym: 4-biphenylcarboxylic acid,biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylic acid,p-phenylbenzoic acid,4-carboxybiphenyl,para phenyl benzoic acid,4-diphenylcarboxylic acid,diphenyl-4-carboxylic acid,4-carboxy-1,1'-biphenyl PubChem CID: 66724 IUPAC Name: 4-phenylbenzoic acid SMILES: C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O
| PubChem CID | 66724 |
|---|---|
| CAS | 92-92-2 |
| Molecular Weight (g/mol) | 198.22 |
| MDL Number | MFCD00002553 |
| SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)O |
| Synonym | 4-biphenylcarboxylic acid,biphenyl-4-carboxylic acid,1,1'-biphenyl-4-carboxylic acid,p-phenylbenzoic acid,4-carboxybiphenyl,para phenyl benzoic acid,4-diphenylcarboxylic acid,diphenyl-4-carboxylic acid,4-carboxy-1,1'-biphenyl |
| IUPAC Name | 4-phenylbenzoic acid |
| InChI Key | NNJMFJSKMRYHSR-UHFFFAOYSA-N |
| Molecular Formula | C13H10O2 |
Bromhexine hydrochloride, 98+%
CAS: 611-75-6 Molecular Formula: C14H21Br2ClN2 Molecular Weight (g/mol): 412.59 MDL Number: MFCD00056626 InChI Key: SXIVGYTWSVJOLM-UHFFFAOYNA-N Synonym: bromhexine hydrochloride,bromhexine hcl,auxit,bisolvon,broncokin,viscolyt,bromohexine hydrochloride,bromhexine chloride,quentan,unii-yc2zom3z8v PubChem CID: 5702220 ChEBI: CHEBI:31303 IUPAC Name: hydrogen 2-(1-amino-1-cyclohexylethyl)-4,6-dibromoaniline chloride SMILES: [H+].[Cl-].CC(N)(C1CCCCC1)C1=CC(Br)=CC(Br)=C1N
| PubChem CID | 5702220 |
|---|---|
| CAS | 611-75-6 |
| Molecular Weight (g/mol) | 412.59 |
| ChEBI | CHEBI:31303 |
| MDL Number | MFCD00056626 |
| SMILES | [H+].[Cl-].CC(N)(C1CCCCC1)C1=CC(Br)=CC(Br)=C1N |
| Synonym | bromhexine hydrochloride,bromhexine hcl,auxit,bisolvon,broncokin,viscolyt,bromohexine hydrochloride,bromhexine chloride,quentan,unii-yc2zom3z8v |
| IUPAC Name | hydrogen 2-(1-amino-1-cyclohexylethyl)-4,6-dibromoaniline chloride |
| InChI Key | SXIVGYTWSVJOLM-UHFFFAOYNA-N |
| Molecular Formula | C14H21Br2ClN2 |
4-Bromo-2-chloro-6-methylaniline, 98%
CAS: 30273-42-8 Molecular Formula: C7H7BrClN Molecular Weight (g/mol): 220.49 MDL Number: MFCD00041432 InChI Key: DIXGIKZIIZRFKE-UHFFFAOYSA-N Synonym: 4-bromo-2-chloro-6-methyl-phenylamine,benzenamine, 4-bromo-2-chloro-6-methyl,pubchem23742,acmc-20a53i,4-bromo-6-chloro-o-toluidine,2-amino-5-bromo-3-chlorotoluene,4-bromo-2-chloro-6-methyl-aniline,4-bromo-6-chloro-2-methylphenylamine,4-bromo-2-chloro-6-methylphenylamine,benzenamine,4-bromo-2-chloro-6-methyl PubChem CID: 2769626 IUPAC Name: 4-bromo-2-chloro-6-methylaniline SMILES: CC1=CC(Br)=CC(Cl)=C1N
| PubChem CID | 2769626 |
|---|---|
| CAS | 30273-42-8 |
| Molecular Weight (g/mol) | 220.49 |
| MDL Number | MFCD00041432 |
| SMILES | CC1=CC(Br)=CC(Cl)=C1N |
| Synonym | 4-bromo-2-chloro-6-methyl-phenylamine,benzenamine, 4-bromo-2-chloro-6-methyl,pubchem23742,acmc-20a53i,4-bromo-6-chloro-o-toluidine,2-amino-5-bromo-3-chlorotoluene,4-bromo-2-chloro-6-methyl-aniline,4-bromo-6-chloro-2-methylphenylamine,4-bromo-2-chloro-6-methylphenylamine,benzenamine,4-bromo-2-chloro-6-methyl |
| IUPAC Name | 4-bromo-2-chloro-6-methylaniline |
| InChI Key | DIXGIKZIIZRFKE-UHFFFAOYSA-N |
| Molecular Formula | C7H7BrClN |
5-Methyl-2-nitrobenzoic acid, 98+%
CAS: 3113-72-2 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.147 MDL Number: MFCD00007368 InChI Key: QRRSIFNWHCKMSW-UHFFFAOYSA-N Synonym: 5-methyl-2-nitrobenzoic acid,2-nitro-5-methylbenzoic acid,benzoic acid, 5-methyl-2-nitro,3-methyl-6-nitrobenzoic acid,6-nitro-m-toluic acid,m-toluic acid, 6-nitro,6-nitro-p-toluic acid,5-methyl-2-nitrobenzoicacid,5-methyl-2-nitro-benzoic acid,benzoic acid,5-methyl-2-nitro PubChem CID: 18371 SMILES: CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O
| PubChem CID | 18371 |
|---|---|
| CAS | 3113-72-2 |
| Molecular Weight (g/mol) | 181.147 |
| MDL Number | MFCD00007368 |
| SMILES | CC1=CC(=C(C=C1)[N+](=O)[O-])C(=O)O |
| Synonym | 5-methyl-2-nitrobenzoic acid,2-nitro-5-methylbenzoic acid,benzoic acid, 5-methyl-2-nitro,3-methyl-6-nitrobenzoic acid,6-nitro-m-toluic acid,m-toluic acid, 6-nitro,6-nitro-p-toluic acid,5-methyl-2-nitrobenzoicacid,5-methyl-2-nitro-benzoic acid,benzoic acid,5-methyl-2-nitro |
| InChI Key | QRRSIFNWHCKMSW-UHFFFAOYSA-N |
| Molecular Formula | C8H7NO4 |
2,4-Dichlorobenzyl chloride, 99%
CAS: 94-99-5 Molecular Formula: C7H5Cl3 Molecular Weight (g/mol): 195.47 MDL Number: MFCD00000895 InChI Key: IRSVDHPYXFLLDS-UHFFFAOYSA-N Synonym: 2,4-dichlorobenzyl chloride,2,4-dichloro-1-chloromethyl benzene,2,4-dichlorobenzylchloride,alpha,2,4-trichlorotoluene,benzene, 2,4-dichloro-1-chloromethyl,2,4-dichloro-1-chloromethyl-benzene,alpha2,4-trichlorotoluene,unii-85e96p2s3s,2,4-dcbc,toluene, .alpha.2,4-trichloro PubChem CID: 7212 IUPAC Name: 2,4-dichloro-1-(chloromethyl)benzene SMILES: ClCC1=CC=C(Cl)C=C1Cl
| PubChem CID | 7212 |
|---|---|
| CAS | 94-99-5 |
| Molecular Weight (g/mol) | 195.47 |
| MDL Number | MFCD00000895 |
| SMILES | ClCC1=CC=C(Cl)C=C1Cl |
| Synonym | 2,4-dichlorobenzyl chloride,2,4-dichloro-1-chloromethyl benzene,2,4-dichlorobenzylchloride,alpha,2,4-trichlorotoluene,benzene, 2,4-dichloro-1-chloromethyl,2,4-dichloro-1-chloromethyl-benzene,alpha2,4-trichlorotoluene,unii-85e96p2s3s,2,4-dcbc,toluene, .alpha.2,4-trichloro |
| IUPAC Name | 2,4-dichloro-1-(chloromethyl)benzene |
| InChI Key | IRSVDHPYXFLLDS-UHFFFAOYSA-N |
| Molecular Formula | C7H5Cl3 |
N-Phenylthiourea, 97%
CAS: 103-85-5 Molecular Formula: C7H8N2S Molecular Weight (g/mol): 152.22 MDL Number: MFCD00004933 InChI Key: FULZLIGZKMKICU-UHFFFAOYSA-N Synonym: n-phenylthiourea,1-phenylthiourea,1-phenyl-2-thiourea,phenylthiocarbamide,thiourea, phenyl,phenyl-2-thiourea,fenylthiomocovina,urea, 1-phenyl-2-thio,rcra waste number p093,phenyl-thiourea PubChem CID: 676454 ChEBI: CHEBI:46261 IUPAC Name: phenylthiourea SMILES: NC(=S)NC1=CC=CC=C1
| PubChem CID | 676454 |
|---|---|
| CAS | 103-85-5 |
| Molecular Weight (g/mol) | 152.22 |
| ChEBI | CHEBI:46261 |
| MDL Number | MFCD00004933 |
| SMILES | NC(=S)NC1=CC=CC=C1 |
| Synonym | n-phenylthiourea,1-phenylthiourea,1-phenyl-2-thiourea,phenylthiocarbamide,thiourea, phenyl,phenyl-2-thiourea,fenylthiomocovina,urea, 1-phenyl-2-thio,rcra waste number p093,phenyl-thiourea |
| IUPAC Name | phenylthiourea |
| InChI Key | FULZLIGZKMKICU-UHFFFAOYSA-N |
| Molecular Formula | C7H8N2S |
2-Amino-5-methylbenzoic acid, 97%
CAS: 2941-78-8 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.17 MDL Number: MFCD00007909 InChI Key: NBUUUJWWOARGNW-UHFFFAOYSA-N Synonym: 5-methylanthranilic acid,6-amino-m-toluic acid,2-amino-5-methyl-benzoic acid,benzoic acid, 2-amino-5-methyl,m-toluic acid, 6-amino,2-amino-5-methylbenzoicacid,unii-418xaj22v2,2-amino-5-methyl benzoic acid,amino 2--5-methylbenzoic acid,pubchem4954 PubChem CID: 76255 IUPAC Name: 2-amino-5-methylbenzoic acid SMILES: CC1=CC=C(N)C(=C1)C(O)=O
| PubChem CID | 76255 |
|---|---|
| CAS | 2941-78-8 |
| Molecular Weight (g/mol) | 151.17 |
| MDL Number | MFCD00007909 |
| SMILES | CC1=CC=C(N)C(=C1)C(O)=O |
| Synonym | 5-methylanthranilic acid,6-amino-m-toluic acid,2-amino-5-methyl-benzoic acid,benzoic acid, 2-amino-5-methyl,m-toluic acid, 6-amino,2-amino-5-methylbenzoicacid,unii-418xaj22v2,2-amino-5-methyl benzoic acid,amino 2--5-methylbenzoic acid,pubchem4954 |
| IUPAC Name | 2-amino-5-methylbenzoic acid |
| InChI Key | NBUUUJWWOARGNW-UHFFFAOYSA-N |
| Molecular Formula | C8H9NO2 |
Diphenylacetonitrile, 99+%
CAS: 86-29-3 Molecular Formula: C14H11N Molecular Weight (g/mol): 193.25 InChI Key: NEBPTMCRLHKPOB-UHFFFAOYSA-N Synonym: diphenylacetonitrile,dipan,diphenatrile,benzhydrylcyanide,diphenylmethylcyanide,benzyhydrylcyanide,acetonitrile, diphenyl,benzeneacetonitrile, alpha-phenyl,usaf kf-13,difenylacetonitril PubChem CID: 6837 IUPAC Name: 2,2-diphenylacetonitrile SMILES: C1=CC=C(C=C1)C(C#N)C2=CC=CC=C2
| PubChem CID | 6837 |
|---|---|
| CAS | 86-29-3 |
| Molecular Weight (g/mol) | 193.25 |
| SMILES | C1=CC=C(C=C1)C(C#N)C2=CC=CC=C2 |
| Synonym | diphenylacetonitrile,dipan,diphenatrile,benzhydrylcyanide,diphenylmethylcyanide,benzyhydrylcyanide,acetonitrile, diphenyl,benzeneacetonitrile, alpha-phenyl,usaf kf-13,difenylacetonitril |
| IUPAC Name | 2,2-diphenylacetonitrile |
| InChI Key | NEBPTMCRLHKPOB-UHFFFAOYSA-N |
| Molecular Formula | C14H11N |