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Benzene and substituted derivatives

Benzene is an aromatic organic molecule composed of six carbon atoms and six hydrogen atoms that form a ring. Includes substituted derivative compounds.
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6,736 – 6,750 of 57,364 results
6,736

4-Methyldiphenylamine 98.0+%, TCI America™

CAS: 620-84-8 Molecular Formula: C13H13N Molecular Weight (g/mol): 183.25 MDL Number: MFCD00092921 InChI Key: AGHYMXKKEXDUTA-UHFFFAOYSA-N Synonym: 4-methyldiphenylamine,benzenamine, 4-methyl-n-phenyl,n-phenyl-p-toluidine,4-methyl-n-phenyl-aniline,4-methyl-n-phenylbenzamine,4-methylphenyl phenylamine,phenyl-p-tolylamine,4-methyldiphenylamin,phenyl-p-tolyl-amine,n-pnenyl-4-methylaniline PubChem CID: 12109 IUPAC Name: 4-methyl-N-phenylaniline SMILES: CC1=CC=C(NC2=CC=CC=C2)C=C1

PubChem CID 12109
CAS 620-84-8
Molecular Weight (g/mol) 183.25
MDL Number MFCD00092921
SMILES CC1=CC=C(NC2=CC=CC=C2)C=C1
Synonym 4-methyldiphenylamine,benzenamine, 4-methyl-n-phenyl,n-phenyl-p-toluidine,4-methyl-n-phenyl-aniline,4-methyl-n-phenylbenzamine,4-methylphenyl phenylamine,phenyl-p-tolylamine,4-methyldiphenylamin,phenyl-p-tolyl-amine,n-pnenyl-4-methylaniline
IUPAC Name 4-methyl-N-phenylaniline
InChI Key AGHYMXKKEXDUTA-UHFFFAOYSA-N
Molecular Formula C13H13N
6,737

2-Methyl-6-nitrobenzoic Anhydride 98.0+%, TCI America™

CAS: 434935-69-0 Molecular Formula: C16H12N2O7 Molecular Weight (g/mol): 344.279 MDL Number: MFCD06797117 InChI Key: YEKPNMQQSPHKBP-UHFFFAOYSA-N Synonym: 6-Nitro-o-toluic Anhydride, MNBA PubChem CID: 10472648 IUPAC Name: (2-methyl-6-nitrobenzoyl) 2-methyl-6-nitrobenzoate SMILES: CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC(=O)C2=C(C=CC=C2[N+](=O)[O-])C

PubChem CID 10472648
CAS 434935-69-0
Molecular Weight (g/mol) 344.279
MDL Number MFCD06797117
SMILES CC1=C(C(=CC=C1)[N+](=O)[O-])C(=O)OC(=O)C2=C(C=CC=C2[N+](=O)[O-])C
Synonym 6-Nitro-o-toluic Anhydride, MNBA
IUPAC Name (2-methyl-6-nitrobenzoyl) 2-methyl-6-nitrobenzoate
InChI Key YEKPNMQQSPHKBP-UHFFFAOYSA-N
Molecular Formula C16H12N2O7
6,738

2-(4-Methoxystyryl)-4,6-bis(trichloromethyl)-1,3,5-triazine 98.0+%, TCI America™

CAS: 42573-57-9 Molecular Formula: C14H9Cl6N3O Molecular Weight (g/mol): 447.946 MDL Number: MFCD01940892 InChI Key: MCNPOZMLKGDJGP-QPJJXVBHSA-N PubChem CID: 6014381 IUPAC Name: 2-[(E)-2-(4-methoxyphenyl)ethenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine SMILES: COC1=CC=C(C=C1)C=CC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl

PubChem CID 6014381
CAS 42573-57-9
Molecular Weight (g/mol) 447.946
MDL Number MFCD01940892
SMILES COC1=CC=C(C=C1)C=CC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl
IUPAC Name 2-[(E)-2-(4-methoxyphenyl)ethenyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
InChI Key MCNPOZMLKGDJGP-QPJJXVBHSA-N
Molecular Formula C14H9Cl6N3O
6,739

4-Methoxy-2-(trifluoromethyl)benzaldehyde 97.0+%, TCI America™

CAS: 106312-36-1 Molecular Formula: C9H7F3O2 Molecular Weight (g/mol): 204.148 MDL Number: MFCD01091011 InChI Key: BVPVUMRIGHMFNV-UHFFFAOYSA-N Synonym: 4-methoxy-2-trifluoromethyl benzaldehyde,benzaldehyde, 4-methoxy-2-trifluoromethyl,4-formyl-3-trifluoromethyl anisole,pubchem1463,acmc-1c5gx,ksc504i7t,2-formyl-5-methoxybenzotrifluoride,4-methoxy-2-trifluoromethyl-benzaldehyde,benzaldehyde,4-methoxy-2-trifluoromethyl PubChem CID: 2778286 IUPAC Name: 4-methoxy-2-(trifluoromethyl)benzaldehyde SMILES: COC1=CC(=C(C=C1)C=O)C(F)(F)F

PubChem CID 2778286
CAS 106312-36-1
Molecular Weight (g/mol) 204.148
MDL Number MFCD01091011
SMILES COC1=CC(=C(C=C1)C=O)C(F)(F)F
Synonym 4-methoxy-2-trifluoromethyl benzaldehyde,benzaldehyde, 4-methoxy-2-trifluoromethyl,4-formyl-3-trifluoromethyl anisole,pubchem1463,acmc-1c5gx,ksc504i7t,2-formyl-5-methoxybenzotrifluoride,4-methoxy-2-trifluoromethyl-benzaldehyde,benzaldehyde,4-methoxy-2-trifluoromethyl
IUPAC Name 4-methoxy-2-(trifluoromethyl)benzaldehyde
InChI Key BVPVUMRIGHMFNV-UHFFFAOYSA-N
Molecular Formula C9H7F3O2
6,740

4-Methoxybenzyl 2,2,2-Trichloroacetimidate 96.0+%, TCI America™

CAS: 89238-99-3 Molecular Formula: C10H10Cl3NO2 Molecular Weight (g/mol): 282.545 MDL Number: MFCD00134547 InChI Key: TYHGKLBJBHACOI-UHFFFAOYSA-N Synonym: 2,2,2-Trichloroacetimidic Acid 4-Methoxybenzyl Ester PubChem CID: 11087263 IUPAC Name: (4-methoxyphenyl)methyl 2,2,2-trichloroethanimidate SMILES: COC1=CC=C(C=C1)COC(=N)C(Cl)(Cl)Cl

PubChem CID 11087263
CAS 89238-99-3
Molecular Weight (g/mol) 282.545
MDL Number MFCD00134547
SMILES COC1=CC=C(C=C1)COC(=N)C(Cl)(Cl)Cl
Synonym 2,2,2-Trichloroacetimidic Acid 4-Methoxybenzyl Ester
IUPAC Name (4-methoxyphenyl)methyl 2,2,2-trichloroethanimidate
InChI Key TYHGKLBJBHACOI-UHFFFAOYSA-N
Molecular Formula C10H10Cl3NO2
6,741

Methyl 4-Hydroxybenzoate 99.0+%, TCI America™

CAS: 99-76-3 Molecular Formula: C8H8O3 Molecular Weight (g/mol): 152.149 MDL Number: MFCD00002352 InChI Key: LXCFILQKKLGQFO-UHFFFAOYSA-N Synonym: methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m PubChem CID: 7456 ChEBI: CHEBI:31835 IUPAC Name: methyl 4-hydroxybenzoate SMILES: COC(=O)C1=CC=C(C=C1)O

PubChem CID 7456
CAS 99-76-3
Molecular Weight (g/mol) 152.149
ChEBI CHEBI:31835
MDL Number MFCD00002352
SMILES COC(=O)C1=CC=C(C=C1)O
Synonym methylparaben,methyl paraben,methyl p-hydroxybenzoate,nipagin,methyl parahydroxybenzoate,maseptol,p-hydroxybenzoic acid methyl ester,4-hydroxybenzoic acid methyl ester,p-carbomethoxyphenol,tegosept m
IUPAC Name methyl 4-hydroxybenzoate
InChI Key LXCFILQKKLGQFO-UHFFFAOYSA-N
Molecular Formula C8H8O3
6,742

Milnacipran Hydrochloride 98.0+%, TCI America™

CAS: 101152-94-7 Molecular Formula: C15H23ClN2O Molecular Weight (g/mol): 282.812 MDL Number: MFCD00901293 InChI Key: XNCDYJFPRPDERF-LKNSGBSQSA-N Synonym: dalcipran,ixel,rac-milnacipran hydrochloride,1r,2s-rel-2 aminomethyl-n,n-diethyl-1-phenyl-cyclopropanecarboxamide, monohydrochloride,2s-2-aminomethyl-n,n-diethyl-1-phenylcyclopropane-1-carboxamide hydrochloride PubChem CID: 45039934 IUPAC Name: (2S)-2-(aminomethyl)-N,N-diethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride SMILES: CCN(CC)C(=O)C1(CC1CN)C2=CC=CC=C2.Cl

PubChem CID 45039934
CAS 101152-94-7
Molecular Weight (g/mol) 282.812
MDL Number MFCD00901293
SMILES CCN(CC)C(=O)C1(CC1CN)C2=CC=CC=C2.Cl
Synonym dalcipran,ixel,rac-milnacipran hydrochloride,1r,2s-rel-2 aminomethyl-n,n-diethyl-1-phenyl-cyclopropanecarboxamide, monohydrochloride,2s-2-aminomethyl-n,n-diethyl-1-phenylcyclopropane-1-carboxamide hydrochloride
IUPAC Name (2S)-2-(aminomethyl)-N,N-diethyl-1-phenylcyclopropane-1-carboxamide;hydrochloride
InChI Key XNCDYJFPRPDERF-LKNSGBSQSA-N
Molecular Formula C15H23ClN2O
6,743

Ethyl 2,4,6-Trimethylbenzoate 95.0+%, TCI America™

CAS: 1754-55-8 Molecular Formula: C12H16O2 Molecular Weight (g/mol): 192.258 MDL Number: MFCD00015439 InChI Key: ZXTXIZPSMQCYBN-UHFFFAOYSA-N Synonym: 2,4,6-Trimethylbenzoic Acid Ethyl Ester, Ethyl Mesitylenecarboxylate, Mesitylenecarboxylic Acid Ethyl Ester PubChem CID: 74465 IUPAC Name: ethyl 2,4,6-trimethylbenzoate SMILES: CCOC(=O)C1=C(C=C(C=C1C)C)C

PubChem CID 74465
CAS 1754-55-8
Molecular Weight (g/mol) 192.258
MDL Number MFCD00015439
SMILES CCOC(=O)C1=C(C=C(C=C1C)C)C
Synonym 2,4,6-Trimethylbenzoic Acid Ethyl Ester, Ethyl Mesitylenecarboxylate, Mesitylenecarboxylic Acid Ethyl Ester
IUPAC Name ethyl 2,4,6-trimethylbenzoate
InChI Key ZXTXIZPSMQCYBN-UHFFFAOYSA-N
Molecular Formula C12H16O2
6,744

Ethyl Violet, TCI America™

CAS: 2390-59-2 Molecular Formula: C31H42ClN3 Molecular Weight (g/mol): 492.15 MDL Number: MFCD00011765 InChI Key: JVICFMRAVNKDOE-UHFFFAOYSA-M Synonym: ethyl violet,basic violet 4,c.i. basic violet 4,ethyl violet ax,ethyl violet gga,ethyl crystal violet,lowacryl violet 4,shikiso acid brilliant blue 6b,ethyl violet biological stain,unii-94uz9rd7tj PubChem CID: 16955 IUPAC Name: tris[4-(diethylamino)phenyl]methylium chloride SMILES: [Cl-].CCN(CC)C1=CC=C(C=C1)[C+](C1=CC=C(C=C1)N(CC)CC)C1=CC=C(C=C1)N(CC)CC

PubChem CID 16955
CAS 2390-59-2
Molecular Weight (g/mol) 492.15
MDL Number MFCD00011765
SMILES [Cl-].CCN(CC)C1=CC=C(C=C1)[C+](C1=CC=C(C=C1)N(CC)CC)C1=CC=C(C=C1)N(CC)CC
Synonym ethyl violet,basic violet 4,c.i. basic violet 4,ethyl violet ax,ethyl violet gga,ethyl crystal violet,lowacryl violet 4,shikiso acid brilliant blue 6b,ethyl violet biological stain,unii-94uz9rd7tj
IUPAC Name tris[4-(diethylamino)phenyl]methylium chloride
InChI Key JVICFMRAVNKDOE-UHFFFAOYSA-M
Molecular Formula C31H42ClN3
6,745

4-Ethylanisole 98.0+%, TCI America™

CAS: 1515-95-3 Molecular Formula: C9H12O Molecular Weight (g/mol): 136.194 MDL Number: MFCD00015176 InChI Key: HDNRAPAFJLXKBV-UHFFFAOYSA-N Synonym: 4-ethylanisole,p-ethylanisole,benzene, 1-ethyl-4-methoxy,anisole, p-ethyl,p-ethylanisol,unii-i71p5qg20s,4-ethyl-1-methoxybenzene,4-ethyl anisole,4-ethylmethoxybenzene,acmc-1btzv PubChem CID: 73690 IUPAC Name: 1-ethyl-4-methoxybenzene SMILES: CCC1=CC=C(C=C1)OC

PubChem CID 73690
CAS 1515-95-3
Molecular Weight (g/mol) 136.194
MDL Number MFCD00015176
SMILES CCC1=CC=C(C=C1)OC
Synonym 4-ethylanisole,p-ethylanisole,benzene, 1-ethyl-4-methoxy,anisole, p-ethyl,p-ethylanisol,unii-i71p5qg20s,4-ethyl-1-methoxybenzene,4-ethyl anisole,4-ethylmethoxybenzene,acmc-1btzv
IUPAC Name 1-ethyl-4-methoxybenzene
InChI Key HDNRAPAFJLXKBV-UHFFFAOYSA-N
Molecular Formula C9H12O
6,746

Monomethyl 5-Nitroisophthalate 98.0+%, TCI America™

CAS: 1955-46-0 Molecular Formula: C9H7NO6 Molecular Weight (g/mol): 225.156 MDL Number: MFCD00009793 InChI Key: ZCRNIIJXDRYWDU-UHFFFAOYSA-N Synonym: 3-methoxycarbonyl-5-nitrobenzoic acid,5-nitroisophthalic acid monomethyl ester,monomethyl 5-nitroisophthalate,methyl 5-nitroisophthalate,mono-methyl 5-nitroisophthalate,mono-methyl-5-nitroisophthalic acid,methyl hydrogen 5-nitroisophthalate,5-nitroisophthalic acid, monomethyl ester,monomethyl-5-nitroisophthalate,monomethyl 5-nitrobenzene-1,3-dicarboxylate PubChem CID: 74776 SMILES: COC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]

PubChem CID 74776
CAS 1955-46-0
Molecular Weight (g/mol) 225.156
MDL Number MFCD00009793
SMILES COC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]
Synonym 3-methoxycarbonyl-5-nitrobenzoic acid,5-nitroisophthalic acid monomethyl ester,monomethyl 5-nitroisophthalate,methyl 5-nitroisophthalate,mono-methyl 5-nitroisophthalate,mono-methyl-5-nitroisophthalic acid,methyl hydrogen 5-nitroisophthalate,5-nitroisophthalic acid, monomethyl ester,monomethyl-5-nitroisophthalate,monomethyl 5-nitrobenzene-1,3-dicarboxylate
InChI Key ZCRNIIJXDRYWDU-UHFFFAOYSA-N
Molecular Formula C9H7NO6
6,747

Potassium Monomethyl Terephthalate 95.0+%, TCI America™

CAS: 42967-55-5 Molecular Formula: C9H7KO4 Molecular Weight (g/mol): 218.249 MDL Number: MFCD00058989 InChI Key: DWNDFZTVSFSFTB-UHFFFAOYSA-M Synonym: Terephthalic Acid Monomethyl Ester Potassium Salt PubChem CID: 23683753 IUPAC Name: potassium;4-methoxycarbonylbenzoate SMILES: COC(=O)C1=CC=C(C=C1)C(=O)[O-].[K+]

PubChem CID 23683753
CAS 42967-55-5
Molecular Weight (g/mol) 218.249
MDL Number MFCD00058989
SMILES COC(=O)C1=CC=C(C=C1)C(=O)[O-].[K+]
Synonym Terephthalic Acid Monomethyl Ester Potassium Salt
IUPAC Name potassium;4-methoxycarbonylbenzoate
InChI Key DWNDFZTVSFSFTB-UHFFFAOYSA-M
Molecular Formula C9H7KO4
6,748

Monoethyl 5-Nitroisophthalate 98.0+%, TCI America™

CAS: 22871-55-2 Molecular Formula: C10H9NO6 Molecular Weight (g/mol): 239.183 MDL Number: MFCD00130051 InChI Key: HOYHBDFTELAGGG-UHFFFAOYSA-N Synonym: 5-Nitroisophthalic Acid Monoethyl Ester PubChem CID: 89872 IUPAC Name: 3-ethoxycarbonyl-5-nitrobenzoic acid SMILES: CCOC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]

PubChem CID 89872
CAS 22871-55-2
Molecular Weight (g/mol) 239.183
MDL Number MFCD00130051
SMILES CCOC(=O)C1=CC(=CC(=C1)C(=O)O)[N+](=O)[O-]
Synonym 5-Nitroisophthalic Acid Monoethyl Ester
IUPAC Name 3-ethoxycarbonyl-5-nitrobenzoic acid
InChI Key HOYHBDFTELAGGG-UHFFFAOYSA-N
Molecular Formula C10H9NO6
6,749

Diethyl 2,5-Dibromoterephthalate 98.0+%, TCI America™

CAS: 18013-97-3 Molecular Formula: C12H12Br2O4 Molecular Weight (g/mol): 380.032 MDL Number: MFCD12407163 InChI Key: WXRSDHICEYICMV-UHFFFAOYSA-N Synonym: 2,5-Dibromoterephthalic Acid Diethyl Ester PubChem CID: 22146229 IUPAC Name: diethyl 2,5-dibromobenzene-1,4-dicarboxylate SMILES: CCOC(=O)C1=CC(=C(C=C1Br)C(=O)OCC)Br

PubChem CID 22146229
CAS 18013-97-3
Molecular Weight (g/mol) 380.032
MDL Number MFCD12407163
SMILES CCOC(=O)C1=CC(=C(C=C1Br)C(=O)OCC)Br
Synonym 2,5-Dibromoterephthalic Acid Diethyl Ester
IUPAC Name diethyl 2,5-dibromobenzene-1,4-dicarboxylate
InChI Key WXRSDHICEYICMV-UHFFFAOYSA-N
Molecular Formula C12H12Br2O4
6,750

Dimethyl 1,4-Naphthalenedicarboxylate 98.0+%, TCI America™

CAS: 7487-15-2 Molecular Formula: C14H12O4 Molecular Weight (g/mol): 244.246 MDL Number: MFCD04038075 InChI Key: OCSXMIBZIHMVCP-UHFFFAOYSA-N Synonym: 1,4-Naphthalenedicarboxylic Acid Dimethyl Ester PubChem CID: 11064621 IUPAC Name: dimethyl naphthalene-1,4-dicarboxylate SMILES: COC(=O)C1=CC=C(C2=CC=CC=C21)C(=O)OC

PubChem CID 11064621
CAS 7487-15-2
Molecular Weight (g/mol) 244.246
MDL Number MFCD04038075
SMILES COC(=O)C1=CC=C(C2=CC=CC=C21)C(=O)OC
Synonym 1,4-Naphthalenedicarboxylic Acid Dimethyl Ester
IUPAC Name dimethyl naphthalene-1,4-dicarboxylate
InChI Key OCSXMIBZIHMVCP-UHFFFAOYSA-N
Molecular Formula C14H12O4