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Benzenoids

Organic compounds that are derived from or have a benzene group in their molecular structure. Benzene is an aromatic organic molecule composed of 6 carbon atoms and 6 hydrogen atoms that form a ring. Includes derivatives and substituted molecules.
Benzene and substituted derivatives (130,195)
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1-hydroxylamino 2-unsubstituted benzenoids (6)

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7,036 – 7,050 of 159,118 results
7,036

3-Bromobenzonitrile 98.0+%, TCI America™

CAS: 6952-59-6 Molecular Formula: C7H4BrN Molecular Weight (g/mol): 182.02 MDL Number: MFCD00001796 InChI Key: STXAVEHFKAXGOX-UHFFFAOYSA-N Synonym: m-bromobenzonitrile,benzonitrile, 3-bromo,benzonitrile, m-bromo,3-cyanobromobenzene,1-bromo-3-cyanobenzene,3-bromobenzenecarbonitrile,3-bromo benzonitrile,3-bromobenzonitride,m-brombenzonitril,3-brombenzonitrile PubChem CID: 23381 IUPAC Name: 3-bromobenzonitrile SMILES: BrC1=CC=CC(=C1)C#N

PubChem CID 23381
CAS 6952-59-6
Molecular Weight (g/mol) 182.02
MDL Number MFCD00001796
SMILES BrC1=CC=CC(=C1)C#N
Synonym m-bromobenzonitrile,benzonitrile, 3-bromo,benzonitrile, m-bromo,3-cyanobromobenzene,1-bromo-3-cyanobenzene,3-bromobenzenecarbonitrile,3-bromo benzonitrile,3-bromobenzonitride,m-brombenzonitril,3-brombenzonitrile
IUPAC Name 3-bromobenzonitrile
InChI Key STXAVEHFKAXGOX-UHFFFAOYSA-N
Molecular Formula C7H4BrN
7,037

2-Bromo-4-nitrotoluene 98.0+%, TCI America™

CAS: 7745-93-9 Molecular Formula: C7H6BrNO2 Molecular Weight (g/mol): 216.034 MDL Number: MFCD00007195 InChI Key: XFZFJQHXWJIBQV-UHFFFAOYSA-N Synonym: 2-bromo-4-nitrotoluene,benzene, 2-bromo-1-methyl-4-nitro,3-bromo-4-methylnitrobenzene,toluene, 2-bromo-4-nitro,3-bromo-4-methyl nitrobenzene,1-bromo-2-methyl-5-nitrobenzene,2-bromo-1-methyl-4-nitro-benzene,pubchem3822,2-bromo-4nitrotoluene,2-bromo4-nitrotoluene PubChem CID: 82189 IUPAC Name: 2-bromo-1-methyl-4-nitrobenzene SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])Br

PubChem CID 82189
CAS 7745-93-9
Molecular Weight (g/mol) 216.034
MDL Number MFCD00007195
SMILES CC1=C(C=C(C=C1)[N+](=O)[O-])Br
Synonym 2-bromo-4-nitrotoluene,benzene, 2-bromo-1-methyl-4-nitro,3-bromo-4-methylnitrobenzene,toluene, 2-bromo-4-nitro,3-bromo-4-methyl nitrobenzene,1-bromo-2-methyl-5-nitrobenzene,2-bromo-1-methyl-4-nitro-benzene,pubchem3822,2-bromo-4nitrotoluene,2-bromo4-nitrotoluene
IUPAC Name 2-bromo-1-methyl-4-nitrobenzene
InChI Key XFZFJQHXWJIBQV-UHFFFAOYSA-N
Molecular Formula C7H6BrNO2
7,038

3-Methyl-4-nitrobenzyl Alcohol 98.0+%, TCI America™

CAS: 80866-75-7 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.164 MDL Number: MFCD00007171 InChI Key: KOVQGYQQVNCUBR-UHFFFAOYSA-N Synonym: 3-methyl-4-nitrobenzyl alcohol,3-methyl-4-nitrophenyl methanol,3-methyl-4-nitrobenzylalcohol,benzenemethanol, 3-methyl-4-nitro,acmc-20an0j,4-nitro-3-methylbenzyl alcohol,3-methyl-4-nitro-phenyl methanol,benzenemethanol,3-methyl-4-nitro,3-methyl-4-nitro-phenyl-methanol,3-methyl-4-nitrophenyl methanol # PubChem CID: 591360 IUPAC Name: (3-methyl-4-nitrophenyl)methanol SMILES: CC1=C(C=CC(=C1)CO)[N+](=O)[O-]

PubChem CID 591360
CAS 80866-75-7
Molecular Weight (g/mol) 167.164
MDL Number MFCD00007171
SMILES CC1=C(C=CC(=C1)CO)[N+](=O)[O-]
Synonym 3-methyl-4-nitrobenzyl alcohol,3-methyl-4-nitrophenyl methanol,3-methyl-4-nitrobenzylalcohol,benzenemethanol, 3-methyl-4-nitro,acmc-20an0j,4-nitro-3-methylbenzyl alcohol,3-methyl-4-nitro-phenyl methanol,benzenemethanol,3-methyl-4-nitro,3-methyl-4-nitro-phenyl-methanol,3-methyl-4-nitrophenyl methanol #
IUPAC Name (3-methyl-4-nitrophenyl)methanol
InChI Key KOVQGYQQVNCUBR-UHFFFAOYSA-N
Molecular Formula C8H9NO3
7,039

Methyl 3-Bromo-4-methylbenzoate 98.0+%, TCI America™

CAS: 104901-43-1 Molecular Formula: C9H9BrO2 Molecular Weight (g/mol): 229.073 MDL Number: MFCD00144769 InChI Key: MASRAGFWFYHMFI-UHFFFAOYSA-N Synonym: 3-bromo-4-methylbenzoic acid methyl ester,methyl 3-bromo-p-toluate,methyl3-bromo-4-methylbenzoate,benzoic acid, 3-bromo-4-methyl-, methyl ester,3-bromo-p-toluic acid methyl ester,3-bromo-4-methyl methyl benzoate,3-bromo-4-methyl-benzoic acid methyl ester,pubchem3967,acmc-2098dw,methyl 3-bromo4-methylbenzoate PubChem CID: 7015747 IUPAC Name: methyl 3-bromo-4-methylbenzoate SMILES: CC1=C(C=C(C=C1)C(=O)OC)Br

PubChem CID 7015747
CAS 104901-43-1
Molecular Weight (g/mol) 229.073
MDL Number MFCD00144769
SMILES CC1=C(C=C(C=C1)C(=O)OC)Br
Synonym 3-bromo-4-methylbenzoic acid methyl ester,methyl 3-bromo-p-toluate,methyl3-bromo-4-methylbenzoate,benzoic acid, 3-bromo-4-methyl-, methyl ester,3-bromo-p-toluic acid methyl ester,3-bromo-4-methyl methyl benzoate,3-bromo-4-methyl-benzoic acid methyl ester,pubchem3967,acmc-2098dw,methyl 3-bromo4-methylbenzoate
IUPAC Name methyl 3-bromo-4-methylbenzoate
InChI Key MASRAGFWFYHMFI-UHFFFAOYSA-N
Molecular Formula C9H9BrO2
7,040

Methyl 4-Chloro-3-methylbenzoate 98.0+%, TCI America™

CAS: 91367-05-4 Molecular Formula: C9H9ClO2 Molecular Weight (g/mol): 184.619 MDL Number: MFCD00151838 InChI Key: QOTGNXMPQNGYDM-UHFFFAOYSA-N Synonym: 4-chloro-3-methylbenzoic acid methyl ester,benzoic acid, 4-chloro-3-methyl-, methyl ester,pubchem3710,acmc-209r8w,2-chloro-5-methoxycarbonyl toluene,methyl 4-chloranyl-3-methyl-benzoate,4-chloro-m-toluic acid methyl ester,4-chloro-3-methylbenzoic acid, methyl ester PubChem CID: 7015786 IUPAC Name: methyl 4-chloro-3-methylbenzoate SMILES: CC1=C(C=CC(=C1)C(=O)OC)Cl

PubChem CID 7015786
CAS 91367-05-4
Molecular Weight (g/mol) 184.619
MDL Number MFCD00151838
SMILES CC1=C(C=CC(=C1)C(=O)OC)Cl
Synonym 4-chloro-3-methylbenzoic acid methyl ester,benzoic acid, 4-chloro-3-methyl-, methyl ester,pubchem3710,acmc-209r8w,2-chloro-5-methoxycarbonyl toluene,methyl 4-chloranyl-3-methyl-benzoate,4-chloro-m-toluic acid methyl ester,4-chloro-3-methylbenzoic acid, methyl ester
IUPAC Name methyl 4-chloro-3-methylbenzoate
InChI Key QOTGNXMPQNGYDM-UHFFFAOYSA-N
Molecular Formula C9H9ClO2
7,041

4-Bromo-2-fluorobenzoic Acid 99.0+%, TCI America™

CAS: 112704-79-7 Molecular Formula: C7H3BrFO2 Molecular Weight (g/mol): 218.00 MDL Number: MFCD00143263 InChI Key: ZQQSRVPOAHYHEL-UHFFFAOYSA-M Synonym: 2-fluoro-4-bromobenzoic acid,4-bromo-2-fluoro-benzoic acid,4-bromo-2-fluorobenzoicacid,benzoic acid, 4-bromo-2-fluoro,pubchem1313,enzalutamide impurity a,acmc-1btmf,2-fluro-4-bromobenzoic acid,ksc174m4p,rarechem al bo 0754 PubChem CID: 302681 IUPAC Name: 4-bromo-2-fluorobenzoate SMILES: [O-]C(=O)C1=CC=C(Br)C=C1F

PubChem CID 302681
CAS 112704-79-7
Molecular Weight (g/mol) 218.00
MDL Number MFCD00143263
SMILES [O-]C(=O)C1=CC=C(Br)C=C1F
Synonym 2-fluoro-4-bromobenzoic acid,4-bromo-2-fluoro-benzoic acid,4-bromo-2-fluorobenzoicacid,benzoic acid, 4-bromo-2-fluoro,pubchem1313,enzalutamide impurity a,acmc-1btmf,2-fluro-4-bromobenzoic acid,ksc174m4p,rarechem al bo 0754
IUPAC Name 4-bromo-2-fluorobenzoate
InChI Key ZQQSRVPOAHYHEL-UHFFFAOYSA-M
Molecular Formula C7H3BrFO2
7,042

Methyl 5-Formylsalicylate 98.0+%, TCI America™

CAS: 41489-76-3 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 MDL Number: MFCD03840784 InChI Key: XJKWVPNWHOCFBR-UHFFFAOYSA-N Synonym: 5-Formylsalicylic Acid Methyl Ester, Methyl 5-Formyl-2-hydroxybenzoate, 5-Formyl-2-hydroxybenzoic Acid Methyl Ester PubChem CID: 14363598 IUPAC Name: methyl 5-formyl-2-hydroxybenzoate SMILES: COC(=O)C1=C(O)C=CC(C=O)=C1

PubChem CID 14363598
CAS 41489-76-3
Molecular Weight (g/mol) 180.16
MDL Number MFCD03840784
SMILES COC(=O)C1=C(O)C=CC(C=O)=C1
Synonym 5-Formylsalicylic Acid Methyl Ester, Methyl 5-Formyl-2-hydroxybenzoate, 5-Formyl-2-hydroxybenzoic Acid Methyl Ester
IUPAC Name methyl 5-formyl-2-hydroxybenzoate
InChI Key XJKWVPNWHOCFBR-UHFFFAOYSA-N
Molecular Formula C9H8O4
7,043

n-Octyl 4-Hydroxybenzoate 98.0+%, TCI America™

CAS: 1219-38-1 Molecular Formula: C15H22O3 Molecular Weight (g/mol): 250.34 MDL Number: MFCD00016482 InChI Key: RIKCMEDSBFQFAL-UHFFFAOYSA-N Synonym: octylparaben,n-octyl 4-hydroxybenzoate,octyl paraben,octyl p-hydroxybenzoate,p-hydroxybenzoic acid octyl ester,benzoic acid, 4-hydroxy-, octyl ester,p-oxybenzoesaureoctylester,4-hydroxybenzoic acid n-octyl ester,unii-4uvk431k6b,p-oxybenzoesaureoctylester german PubChem CID: 14642 IUPAC Name: octyl 4-hydroxybenzoate SMILES: CCCCCCCCOC(=O)C1=CC=C(O)C=C1

PubChem CID 14642
CAS 1219-38-1
Molecular Weight (g/mol) 250.34
MDL Number MFCD00016482
SMILES CCCCCCCCOC(=O)C1=CC=C(O)C=C1
Synonym octylparaben,n-octyl 4-hydroxybenzoate,octyl paraben,octyl p-hydroxybenzoate,p-hydroxybenzoic acid octyl ester,benzoic acid, 4-hydroxy-, octyl ester,p-oxybenzoesaureoctylester,4-hydroxybenzoic acid n-octyl ester,unii-4uvk431k6b,p-oxybenzoesaureoctylester german
IUPAC Name octyl 4-hydroxybenzoate
InChI Key RIKCMEDSBFQFAL-UHFFFAOYSA-N
Molecular Formula C15H22O3
7,044

Heptyl 4-Hydroxybenzoate 98.0+%, TCI America™

CAS: 1085-12-7 Molecular Formula: C14H20O3 Molecular Weight (g/mol): 236.31 MDL Number: MFCD00016481 InChI Key: ZTJORNVITHUQJA-UHFFFAOYSA-N Synonym: heptylparaben,heptyl paraben,heptyl p-hydroxybenzoate,n-heptyl 4-hydroxybenzoate,nipaheptyl,staypro ws 7,n-heptyl p-hydroxybenzoate,benzoic acid, 4-hydroxy-, heptyl ester,p-hydroxybenzoic acid heptyl ester,p-oxybenzoesaureheptylester PubChem CID: 14138 ChEBI: CHEBI:34788 IUPAC Name: heptyl 4-hydroxybenzoate SMILES: CCCCCCCOC(=O)C1=CC=C(O)C=C1

PubChem CID 14138
CAS 1085-12-7
Molecular Weight (g/mol) 236.31
ChEBI CHEBI:34788
MDL Number MFCD00016481
SMILES CCCCCCCOC(=O)C1=CC=C(O)C=C1
Synonym heptylparaben,heptyl paraben,heptyl p-hydroxybenzoate,n-heptyl 4-hydroxybenzoate,nipaheptyl,staypro ws 7,n-heptyl p-hydroxybenzoate,benzoic acid, 4-hydroxy-, heptyl ester,p-hydroxybenzoic acid heptyl ester,p-oxybenzoesaureheptylester
IUPAC Name heptyl 4-hydroxybenzoate
InChI Key ZTJORNVITHUQJA-UHFFFAOYSA-N
Molecular Formula C14H20O3
7,045

Propyl 4-Hydroxybenzoate 99.0+%, TCI America™

CAS: 94-13-3 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00002354 InChI Key: QELSKZZBTMNZEB-UHFFFAOYSA-N Synonym: propylparaben,propyl paraben,4-hydroxybenzoic acid propyl ester,propyl p-hydroxybenzoate,nipasol,nipazol,propyl butex,betacide p,propyl parahydroxybenzoate,propylparasept PubChem CID: 7175 ChEBI: CHEBI:32063 IUPAC Name: propyl 4-hydroxybenzoate SMILES: CCCOC(=O)C1=CC=C(C=C1)O

PubChem CID 7175
CAS 94-13-3
Molecular Weight (g/mol) 180.203
ChEBI CHEBI:32063
MDL Number MFCD00002354
SMILES CCCOC(=O)C1=CC=C(C=C1)O
Synonym propylparaben,propyl paraben,4-hydroxybenzoic acid propyl ester,propyl p-hydroxybenzoate,nipasol,nipazol,propyl butex,betacide p,propyl parahydroxybenzoate,propylparasept
IUPAC Name propyl 4-hydroxybenzoate
InChI Key QELSKZZBTMNZEB-UHFFFAOYSA-N
Molecular Formula C10H12O3
7,046

Isobutyl Salicylate 99.0+%, TCI America™

CAS: 87-19-4 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00020035 InChI Key: PTXDBYSCVQQBNF-UHFFFAOYSA-N Synonym: 2-Hydroxybenzoic Acid Isobutyl Ester, Salicylic Acid Isobutyl Ester PubChem CID: 6873 IUPAC Name: 2-methylpropyl 2-hydroxybenzoate SMILES: CC(C)COC(=O)C1=CC=CC=C1O

PubChem CID 6873
CAS 87-19-4
Molecular Weight (g/mol) 194.23
MDL Number MFCD00020035
SMILES CC(C)COC(=O)C1=CC=CC=C1O
Synonym 2-Hydroxybenzoic Acid Isobutyl Ester, Salicylic Acid Isobutyl Ester
IUPAC Name 2-methylpropyl 2-hydroxybenzoate
InChI Key PTXDBYSCVQQBNF-UHFFFAOYSA-N
Molecular Formula C11H14O3
7,047

Methyl 5-Hydroxyanthranilate 98.0+%, TCI America™

CAS: 1882-72-0 Molecular Formula: C8H9NO3 Molecular Weight (g/mol): 167.16 MDL Number: MFCD05863263 InChI Key: DWBKSTKVIIRFHL-UHFFFAOYSA-N Synonym: 5-Hydroxyanthranilic Acid Methyl Ester, Methyl 2-Amino-5-hydroxybenzoate, 2-Amino-5-hydroxybenzoic Acid Methyl Ester PubChem CID: 819940 IUPAC Name: methyl 2-amino-5-hydroxybenzoate SMILES: COC(=O)C1=C(N)C=CC(O)=C1

PubChem CID 819940
CAS 1882-72-0
Molecular Weight (g/mol) 167.16
MDL Number MFCD05863263
SMILES COC(=O)C1=C(N)C=CC(O)=C1
Synonym 5-Hydroxyanthranilic Acid Methyl Ester, Methyl 2-Amino-5-hydroxybenzoate, 2-Amino-5-hydroxybenzoic Acid Methyl Ester
IUPAC Name methyl 2-amino-5-hydroxybenzoate
InChI Key DWBKSTKVIIRFHL-UHFFFAOYSA-N
Molecular Formula C8H9NO3
7,048

Methyl 3,4-Dihydroxybenzoate 98.0+%, TCI America™

CAS: 2150-43-8 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.15 MDL Number: MFCD00016437 InChI Key: CUFLZUDASVUNOE-UHFFFAOYSA-N Synonym: methyl protocatechuate,protocatechuic acid, methyl ester,3,4-dihydroxybenzoic acid methyl ester,protocatechuic acid methyl ester,benzoic acid, 3,4-dihydroxy-, methyl ester,3,4-dihydroxymethylbenzoate,3,4-dihydroxybenzoic acid methyl,mdhb,methyl 3,4-dihydroxy,acmc-1cfbz PubChem CID: 287064 IUPAC Name: methyl 3,4-dihydroxybenzoate SMILES: COC(=O)C1=CC=C(O)C(O)=C1

PubChem CID 287064
CAS 2150-43-8
Molecular Weight (g/mol) 168.15
MDL Number MFCD00016437
SMILES COC(=O)C1=CC=C(O)C(O)=C1
Synonym methyl protocatechuate,protocatechuic acid, methyl ester,3,4-dihydroxybenzoic acid methyl ester,protocatechuic acid methyl ester,benzoic acid, 3,4-dihydroxy-, methyl ester,3,4-dihydroxymethylbenzoate,3,4-dihydroxybenzoic acid methyl,mdhb,methyl 3,4-dihydroxy,acmc-1cfbz
IUPAC Name methyl 3,4-dihydroxybenzoate
InChI Key CUFLZUDASVUNOE-UHFFFAOYSA-N
Molecular Formula C8H8O4
7,049

Methyl 2,3-Dihydroxybenzoate 98.0+%, TCI America™

CAS: 2411-83-8 Molecular Formula: C8H8O4 Molecular Weight (g/mol): 168.148 InChI Key: DOAJWTSNTNAEIY-UHFFFAOYSA-N Synonym: o-pyrocatechuic acid, methyl ester,methyl2,3-dihydroxybenzoate,2,3-dihydroxybenzoic acid methyl ester,benzoic acid, 2,3-dihydroxy-, methyl ester,2,3-dihydroxy-benzoic acid methyl ester,acmc-1ckr1,methyl 2,3-dihydroxy-benzoate,rarechem al bf 0035,2,3-dihydroxybenzoic acid methyl,dihydroxy benzoic acid methyl ester PubChem CID: 75484 IUPAC Name: methyl 2,3-dihydroxybenzoate SMILES: COC(=O)C1=C(C(=CC=C1)O)O

PubChem CID 75484
CAS 2411-83-8
Molecular Weight (g/mol) 168.148
SMILES COC(=O)C1=C(C(=CC=C1)O)O
Synonym o-pyrocatechuic acid, methyl ester,methyl2,3-dihydroxybenzoate,2,3-dihydroxybenzoic acid methyl ester,benzoic acid, 2,3-dihydroxy-, methyl ester,2,3-dihydroxy-benzoic acid methyl ester,acmc-1ckr1,methyl 2,3-dihydroxy-benzoate,rarechem al bf 0035,2,3-dihydroxybenzoic acid methyl,dihydroxy benzoic acid methyl ester
IUPAC Name methyl 2,3-dihydroxybenzoate
InChI Key DOAJWTSNTNAEIY-UHFFFAOYSA-N
Molecular Formula C8H8O4
7,050

Ethyl 6-Methylsalicylate 98.0+%, TCI America™

CAS: 6555-40-4 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD01194299 InChI Key: KWXBNUYCDMPLEQ-UHFFFAOYSA-N Synonym: Ethyl 2-Hydroxy-6-methylbenzoate, 2-Hydroxy-6-methylbenzoic Acid Ethyl Ester, 6-Methylsalicylic Acid Ethyl Ester PubChem CID: 584222 IUPAC Name: ethyl 2-hydroxy-6-methylbenzoate SMILES: CCOC(=O)C1=C(C=CC=C1O)C

PubChem CID 584222
CAS 6555-40-4
Molecular Weight (g/mol) 180.203
MDL Number MFCD01194299
SMILES CCOC(=O)C1=C(C=CC=C1O)C
Synonym Ethyl 2-Hydroxy-6-methylbenzoate, 2-Hydroxy-6-methylbenzoic Acid Ethyl Ester, 6-Methylsalicylic Acid Ethyl Ester
IUPAC Name ethyl 2-hydroxy-6-methylbenzoate
InChI Key KWXBNUYCDMPLEQ-UHFFFAOYSA-N
Molecular Formula C10H12O3