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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 (64,928)
Phenols (11,906)
Naphthalenes (4,958)
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Unsubstituted Phenols (1,173)
Thiophenols (610)
Phenol esters (426)
Anthracenes (400)
Tetralins (329)
Phenanthrenes and derivatives (300)
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Pentacenequinones (16)
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1-hydroxylamino 2-unsubstituted benzenoids (5)

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4,006 – 4,020 of 73,813 results
4,006

5-Bromo-2-iodobenzonitrile, 98+%

CAS: 121554-10-7 Molecular Formula: C7H3BrIN Molecular Weight (g/mol): 307.916 MDL Number: MFCD00672950 InChI Key: JIGKPMMZNMQXDL-UHFFFAOYSA-N PubChem CID: 7020874 IUPAC Name: 5-bromo-2-iodobenzonitrile SMILES: C1=CC(=C(C=C1Br)C#N)I

PubChem CID 7020874
CAS 121554-10-7
Molecular Weight (g/mol) 307.916
MDL Number MFCD00672950
SMILES C1=CC(=C(C=C1Br)C#N)I
IUPAC Name 5-bromo-2-iodobenzonitrile
InChI Key JIGKPMMZNMQXDL-UHFFFAOYSA-N
Molecular Formula C7H3BrIN
4,007

2,5-Difluorobenzyl bromide, 98%

CAS: 85117-99-3 Molecular Formula: C7H5BrF2 Molecular Weight (g/mol): 207.02 MDL Number: MFCD00009897 InChI Key: ONWGSWNHQZYCFK-UHFFFAOYSA-N Synonym: 2,5-difluorobenzyl bromide,2-bromomethyl-1,4-difluorobenzene,2,5-difluorobenzylbromide,alpha-bromo-2,5-difluorotoluene,benzene, 2-bromomethyl-1,4-difluoro,timtec-bb sbb006680,2-bromomethyl-1,4-difluoro-benzene,pubchem10213,2,2-difluorobenzylbromide,acmc-209q4i PubChem CID: 522830 IUPAC Name: 2-(bromomethyl)-1,4-difluorobenzene SMILES: FC1=CC=C(F)C(CBr)=C1

PubChem CID 522830
CAS 85117-99-3
Molecular Weight (g/mol) 207.02
MDL Number MFCD00009897
SMILES FC1=CC=C(F)C(CBr)=C1
Synonym 2,5-difluorobenzyl bromide,2-bromomethyl-1,4-difluorobenzene,2,5-difluorobenzylbromide,alpha-bromo-2,5-difluorotoluene,benzene, 2-bromomethyl-1,4-difluoro,timtec-bb sbb006680,2-bromomethyl-1,4-difluoro-benzene,pubchem10213,2,2-difluorobenzylbromide,acmc-209q4i
IUPAC Name 2-(bromomethyl)-1,4-difluorobenzene
InChI Key ONWGSWNHQZYCFK-UHFFFAOYSA-N
Molecular Formula C7H5BrF2
4,008

2,4,6-Trifluorobenzoyl chloride, 97%

CAS: 79538-29-7 Molecular Formula: C7H2ClF3O Molecular Weight (g/mol): 194.537 MDL Number: MFCD00070810 InChI Key: SIFIJQFBERMWMU-UHFFFAOYSA-N Synonym: 2,4,6-trifluorobenzoylchloride,2,4,6-trifluoro-benzoyl chloride,acmc-20aof3,timtec-bb sbb005827,2,4,6-tri-fluorobenzoyl chloride,2,4,6-trifluorobenzoyl chloride,benzoyl chloride,2,4,6-trifluoro,benzoyl chloride, 2,4,6-trifluoro,2,4,6-trifluorobenzoyl chloride 1g,benzoyl chloride, 2,4,6-trifluoro-9ci PubChem CID: 144895 IUPAC Name: 2,4,6-trifluorobenzoyl chloride SMILES: C1=C(C=C(C(=C1F)C(=O)Cl)F)F

PubChem CID 144895
CAS 79538-29-7
Molecular Weight (g/mol) 194.537
MDL Number MFCD00070810
SMILES C1=C(C=C(C(=C1F)C(=O)Cl)F)F
Synonym 2,4,6-trifluorobenzoylchloride,2,4,6-trifluoro-benzoyl chloride,acmc-20aof3,timtec-bb sbb005827,2,4,6-tri-fluorobenzoyl chloride,2,4,6-trifluorobenzoyl chloride,benzoyl chloride,2,4,6-trifluoro,benzoyl chloride, 2,4,6-trifluoro,2,4,6-trifluorobenzoyl chloride 1g,benzoyl chloride, 2,4,6-trifluoro-9ci
IUPAC Name 2,4,6-trifluorobenzoyl chloride
InChI Key SIFIJQFBERMWMU-UHFFFAOYSA-N
Molecular Formula C7H2ClF3O
4,009

Benzyl Alcohol, BAKER ANALYZED™ Reagent, J.T. Baker™

CAS: 100-51-6 Molecular Formula: C7H8O Molecular Weight (g/mol): 108.14 MDL Number: MFCD00004599,MFCD03792087 InChI Key: WVDDGKGOMKODPV-UHFFFAOYSA-N Synonym: 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

PubChem CID 244
CAS 100-51-6
Molecular Weight (g/mol) 108.14
ChEBI CHEBI:17987
MDL Number MFCD00004599,MFCD03792087
SMILES OCC1=CC=CC=C1
Synonym benzyl alcohol,benzenemethanol,phenylcarbinol,benzoyl alcohol,hydroxytoluene,benzenecarbinol,phenylmethyl alcohol,alpha-toluenol,hydroxymethyl benzene,benzylalcohol
IUPAC Name phenylmethanol
InChI Key WVDDGKGOMKODPV-UHFFFAOYSA-N
Molecular Formula C7H8O
4,010

3-tert-Butylaniline, 97%

CAS: 5369-19-7 Molecular Formula: C10H15N Molecular Weight (g/mol): 149.24 MDL Number: MFCD00125078 InChI Key: DPKTVUKEPNBABS-UHFFFAOYSA-N Synonym: 3-tert-butyl aniline,3-tert-butylbenzenamine,benzenamine, 3-1,1-dimethylethyl,3-t-butyl aniline,3-tert-butyl-phenylamine,3-tert-butyl phenylamine,3-tert-butylphenyl amine,m-t-butylaniline,3-t-butylaniline,m-tert-butylaniline PubChem CID: 79334 IUPAC Name: 3-tert-butylaniline SMILES: CC(C)(C)C1=CC=CC(N)=C1

PubChem CID 79334
CAS 5369-19-7
Molecular Weight (g/mol) 149.24
MDL Number MFCD00125078
SMILES CC(C)(C)C1=CC=CC(N)=C1
Synonym 3-tert-butyl aniline,3-tert-butylbenzenamine,benzenamine, 3-1,1-dimethylethyl,3-t-butyl aniline,3-tert-butyl-phenylamine,3-tert-butyl phenylamine,3-tert-butylphenyl amine,m-t-butylaniline,3-t-butylaniline,m-tert-butylaniline
IUPAC Name 3-tert-butylaniline
InChI Key DPKTVUKEPNBABS-UHFFFAOYSA-N
Molecular Formula C10H15N
4,012

Iodopentafluorobenzene, 99%, stabilised over copper

CAS: 827-15-6 Molecular Formula: C6F5I Molecular Weight (g/mol): 293.96 InChI Key: OPYHNLNYCRZOGY-UHFFFAOYSA-N Synonym: iodopentafluorobenzene,pentafluoroiodobenzene,benzene, pentafluoroiodo,2,3,4,5,6-pentafluoroiodobenzene,iodoperfluorobenzene,pentafluorophenyl iodide,1,2,3,4,5-pentafluoro-6-iodo-benzene,perfluoroiodobenzene,ibf,pubchem19982 PubChem CID: 70008 IUPAC Name: 1,2,3,4,5-pentafluoro-6-iodobenzene SMILES: C1(=C(C(=C(C(=C1F)F)I)F)F)F

PubChem CID 70008
CAS 827-15-6
Molecular Weight (g/mol) 293.96
SMILES C1(=C(C(=C(C(=C1F)F)I)F)F)F
Synonym iodopentafluorobenzene,pentafluoroiodobenzene,benzene, pentafluoroiodo,2,3,4,5,6-pentafluoroiodobenzene,iodoperfluorobenzene,pentafluorophenyl iodide,1,2,3,4,5-pentafluoro-6-iodo-benzene,perfluoroiodobenzene,ibf,pubchem19982
IUPAC Name 1,2,3,4,5-pentafluoro-6-iodobenzene
InChI Key OPYHNLNYCRZOGY-UHFFFAOYSA-N
Molecular Formula C6F5I
4,013

[(N-Benzyl-N-methylammonium)methyl]trifluoroborate internal salt, 95 %, Thermo Scientific Chemicals

CAS: 1268341-00-9 Molecular Formula: C9H13BF3N Molecular Weight (g/mol): 203.015 MDL Number: MFCD20134169 InChI Key: JRTRNQRZOUGDCI-UHFFFAOYSA-O Synonym: n-benzyl-n-methylammonium methyl trifluoroborate internal salt,benzyl methyl ammonio methyl trifluoroboranuide PubChem CID: 53243645 IUPAC Name: [benzyl(methyl)azaniumyl]methyl-trifluoroboranuide SMILES: [B-](C[NH+](C)CC1=CC=CC=C1)(F)(F)F

PubChem CID 53243645
CAS 1268341-00-9
Molecular Weight (g/mol) 203.015
MDL Number MFCD20134169
SMILES [B-](C[NH+](C)CC1=CC=CC=C1)(F)(F)F
Synonym n-benzyl-n-methylammonium methyl trifluoroborate internal salt,benzyl methyl ammonio methyl trifluoroboranuide
IUPAC Name [benzyl(methyl)azaniumyl]methyl-trifluoroboranuide
InChI Key JRTRNQRZOUGDCI-UHFFFAOYSA-O
Molecular Formula C9H13BF3N
4,014

(+/-)-1,1'-Bi(2-naphthol), 99%

CAS: 602-09-5 Molecular Formula: C20H14O2 Molecular Weight (g/mol): 286.33 MDL Number: MFCD00004068 InChI Key: PPTXVXKCQZKFBN-UHFFFAOYSA-N Synonym: 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol PubChem CID: 11762 IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol SMILES: C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O

PubChem CID 11762
CAS 602-09-5
Molecular Weight (g/mol) 286.33
MDL Number MFCD00004068
SMILES C1=CC=C2C(=C1)C=CC(=C2C3=C(C=CC4=CC=CC=C43)O)O
Synonym 1,1'-bi-2-naphthol,s---1,1'-bi-2-naphthol,r-+-1,1'-bi-2-naphthol,1,1'-binaphthalene-2,2'-diol,binol,1,1'-binaphthyl-2,2'-diol,2,2'-dinaphthol,beta-binaphthol,r-1,1'-bi-2-naphthol,s-1,1'-binaphthalene-2,2'-diol
IUPAC Name 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol
InChI Key PPTXVXKCQZKFBN-UHFFFAOYSA-N
Molecular Formula C20H14O2
4,015

3-Amino-4-chlorobenzamide, 97%

CAS: 19694-10-1 Molecular Formula: C7H7ClN2O Molecular Weight (g/mol): 170.60 MDL Number: MFCD00035785 InChI Key: QHMDKGRWJVOUFU-UHFFFAOYSA-N PubChem CID: 88200 IUPAC Name: 3-amino-4-chlorobenzamide SMILES: NC(=O)C1=CC=C(Cl)C(N)=C1

PubChem CID 88200
CAS 19694-10-1
Molecular Weight (g/mol) 170.60
MDL Number MFCD00035785
SMILES NC(=O)C1=CC=C(Cl)C(N)=C1
IUPAC Name 3-amino-4-chlorobenzamide
InChI Key QHMDKGRWJVOUFU-UHFFFAOYSA-N
Molecular Formula C7H7ClN2O
4,016

4-Cyanophenylacetonitrile, 97%

CAS: 876-31-3 Molecular Formula: C9H6N2 Molecular Weight (g/mol): 142.16 MDL Number: MFCD00060305 InChI Key: QILKKAFYAFEWGU-UHFFFAOYSA-N Synonym: 4-cyanomethyl benzonitrile,4-cyanophenylacetonitrile,benzeneacetonitrile, 4-cyano,p-tolunitrile, .alpha.-cyano,p-cyanobenzylcyanide,4-cyanobenzeneacetonitrile,.alpha.-cyano-p-tolunitrile,4-cyanbenzylcyanide,4-cyanobenzylcyanide,acmc-209qoz PubChem CID: 136686 IUPAC Name: 4-(cyanomethyl)benzonitrile SMILES: N#CCC1=CC=C(C=C1)C#N

PubChem CID 136686
CAS 876-31-3
Molecular Weight (g/mol) 142.16
MDL Number MFCD00060305
SMILES N#CCC1=CC=C(C=C1)C#N
Synonym 4-cyanomethyl benzonitrile,4-cyanophenylacetonitrile,benzeneacetonitrile, 4-cyano,p-tolunitrile, .alpha.-cyano,p-cyanobenzylcyanide,4-cyanobenzeneacetonitrile,.alpha.-cyano-p-tolunitrile,4-cyanbenzylcyanide,4-cyanobenzylcyanide,acmc-209qoz
IUPAC Name 4-(cyanomethyl)benzonitrile
InChI Key QILKKAFYAFEWGU-UHFFFAOYSA-N
Molecular Formula C9H6N2
4,017

Benzyltriphenylphosphonium bromide, 98%

CAS: 1449-46-3 Molecular Formula: C25H22BrP Molecular Weight (g/mol): 433.33 MDL Number: MFCD00031707 InChI Key: WTEPWWCRWNCUNA-UHFFFAOYSA-M Synonym: benzyltriphenylphosphonium bromide,bromo benzyl triphenylphosphorane,benzyltriphenylphosphanium bromide,phenylmethyl triphenylphosphonium bromide,benzyl triphenylphosphonium bromide,benzyl triphenyl phosphonium bromide,phosphonium, triphenyl phenylmethyl-, bromide,acmc-1ch0e,ksc491k3n PubChem CID: 2734970 IUPAC Name: benzyl(triphenyl)phosphanium;bromide SMILES: [Br-].C(C1=CC=CC=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 2734970
CAS 1449-46-3
Molecular Weight (g/mol) 433.33
MDL Number MFCD00031707
SMILES [Br-].C(C1=CC=CC=C1)[P+](C1=CC=CC=C1)(C1=CC=CC=C1)C1=CC=CC=C1
Synonym benzyltriphenylphosphonium bromide,bromo benzyl triphenylphosphorane,benzyltriphenylphosphanium bromide,phenylmethyl triphenylphosphonium bromide,benzyl triphenylphosphonium bromide,benzyl triphenyl phosphonium bromide,phosphonium, triphenyl phenylmethyl-, bromide,acmc-1ch0e,ksc491k3n
IUPAC Name benzyl(triphenyl)phosphanium;bromide
InChI Key WTEPWWCRWNCUNA-UHFFFAOYSA-M
Molecular Formula C25H22BrP
4,018

(4-Nitrobenzyl)triphenylphosphonium bromide, 98%

CAS: 2767-70-6 Molecular Formula: C25H21BrNO2P Molecular Weight (g/mol): 478.33 MDL Number: MFCD00032108 InChI Key: IPJPTPFIJLFWLP-UHFFFAOYSA-M Synonym: 4-nitrobenzyl triphenylphosphonium bromide,p-nitrobenzyl triphenylphosphonium bromide,phosphonium, p-nitrobenzyl triphenyl-, bromide,4-nitrobenzyl triphenylphosphoniumbromide,4-nitrobenzyl triphenyl phosphonium bromide,4-nitrophenyl methyl triphenylphosphanium bromide,acmc-209gym,phosphonium, 4-nitrophenyl methyl triphenyl-, bromide,wln: wnr d1pr&r&r &e,4-nitrobenzyltriphenylphosphonium bromide PubChem CID: 197008 IUPAC Name: (4-nitrophenyl)methyl-triphenylphosphanium;bromide SMILES: [Br-].[O-][N+](=O)C1=CC=C(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1

PubChem CID 197008
CAS 2767-70-6
Molecular Weight (g/mol) 478.33
MDL Number MFCD00032108
SMILES [Br-].[O-][N+](=O)C1=CC=C(C[P+](C2=CC=CC=C2)(C2=CC=CC=C2)C2=CC=CC=C2)C=C1
Synonym 4-nitrobenzyl triphenylphosphonium bromide,p-nitrobenzyl triphenylphosphonium bromide,phosphonium, p-nitrobenzyl triphenyl-, bromide,4-nitrobenzyl triphenylphosphoniumbromide,4-nitrobenzyl triphenyl phosphonium bromide,4-nitrophenyl methyl triphenylphosphanium bromide,acmc-209gym,phosphonium, 4-nitrophenyl methyl triphenyl-, bromide,wln: wnr d1pr&r&r &e,4-nitrobenzyltriphenylphosphonium bromide
IUPAC Name (4-nitrophenyl)methyl-triphenylphosphanium;bromide
InChI Key IPJPTPFIJLFWLP-UHFFFAOYSA-M
Molecular Formula C25H21BrNO2P
4,019

2-Methyl-5-nitrobenzoic acid, 99+%, Thermo Scientific™

CAS: 1975-52-6 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00007371 InChI Key: DJRFJAVPROZZFL-UHFFFAOYSA-N Synonym: 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244 PubChem CID: 519683 SMILES: CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O

PubChem CID 519683
CAS 1975-52-6
Molecular Weight (g/mol) 181.15
MDL Number MFCD00007371
SMILES CC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)O
Synonym 2-methyl-5-nitrobenzoic acid,5-nitro-o-toluic acid,benzoic acid, 2-methyl-5-nitro,2-methyl-5-nitro-benzoic acid,5-nitro-2-methylbenzoic acid,rarechem al bo 0285,5-nitro-2-methyl benzoic acid,2-methyl-5-nitro benzoic acid,pubchem2244
InChI Key DJRFJAVPROZZFL-UHFFFAOYSA-N
Molecular Formula C8H7NO4
4,020

2-Chloro-5-nitrobenzoic Acid, 99+%

CAS: 2516-96-3 Molecular Formula: C7H4ClNO4 Molecular Weight (g/mol): 201.56 MDL Number: MFCD00007294 InChI Key: QUEKGYQTRJVEQC-UHFFFAOYSA-N Synonym: 2-chloro-5-nitrobenzoic acid,benzoic acid, 2-chloro-5-nitro,6-chloro-3-nitrobenzoic acid,2-chloro-5-nitro-benzoic acid,2-chloro-5-nitrobenzoicacid,mesalamine impurity m,pubchem13682,acmc-1cb0i,2-chloro-5-nitrobenzic acid,5-nitro-2-chlorobenzoic acid PubChem CID: 17287 SMILES: C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Cl

PubChem CID 17287
CAS 2516-96-3
Molecular Weight (g/mol) 201.56
MDL Number MFCD00007294
SMILES C1=CC(=C(C=C1[N+](=O)[O-])C(=O)O)Cl
Synonym 2-chloro-5-nitrobenzoic acid,benzoic acid, 2-chloro-5-nitro,6-chloro-3-nitrobenzoic acid,2-chloro-5-nitro-benzoic acid,2-chloro-5-nitrobenzoicacid,mesalamine impurity m,pubchem13682,acmc-1cb0i,2-chloro-5-nitrobenzic acid,5-nitro-2-chlorobenzoic acid
InChI Key QUEKGYQTRJVEQC-UHFFFAOYSA-N
Molecular Formula C7H4ClNO4