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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 (64,917)
Phenols (11,904)
Naphthalenes (4,958)
Fluorenes (1,242)
Unsubstituted Phenols (1,173)
Thiophenols (609)
Phenol esters (426)
Anthracenes (400)
Tetralins (329)
Phenanthrenes and derivatives (300)
Triphenyl compounds (290)
Indanes (288)
Pyrenes (217)
Dibenzocycloheptenes (65)
Ellagic acids and derivatives (33)
Naphthacenes (31)
Acenaphthylenes (16)
Pentacenequinones (16)
Pentacenes (15)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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9,436 – 9,450 of 73,799 results
9,436

4-Amino-2,3,5,6-tetrafluorobenzoic Acid 97.0+%, TCI America™
SDP

CAS: 944-43-4 Molecular Formula: C7H3F4NO2 Molecular Weight (g/mol): 209.1 MDL Number: MFCD00007647 InChI Key: WTNSXWSOTDBWOR-UHFFFAOYSA-N Synonym: 2,3,5,6-tetrafluoro-4-aminobenzoic acid,acmc-209rrw,4-amino-2,3,5,6-tetrafluorobenzoicacid,2,3,5,6-tetrafluoro-4-amino-benzoic acid,4-amino-2,3,5,6-tetrafluoro-benzoic acid,benzoic acid,4-amino-2,3,5,6-tetrafluoro,benzoic acid, 4-amino-2,3,5,6-tetrafluoro,4-amino-2,3,5,6-tetrafluorobenzoic acid PubChem CID: 70345 IUPAC Name: 4-amino-2,3,5,6-tetrafluorobenzoic acid SMILES: C1(=C(C(=C(C(=C1F)F)N)F)F)C(=O)O

PubChem CID 70345
CAS 944-43-4
Molecular Weight (g/mol) 209.1
MDL Number MFCD00007647
SMILES C1(=C(C(=C(C(=C1F)F)N)F)F)C(=O)O
Synonym 2,3,5,6-tetrafluoro-4-aminobenzoic acid,acmc-209rrw,4-amino-2,3,5,6-tetrafluorobenzoicacid,2,3,5,6-tetrafluoro-4-amino-benzoic acid,4-amino-2,3,5,6-tetrafluoro-benzoic acid,benzoic acid,4-amino-2,3,5,6-tetrafluoro,benzoic acid, 4-amino-2,3,5,6-tetrafluoro,4-amino-2,3,5,6-tetrafluorobenzoic acid
IUPAC Name 4-amino-2,3,5,6-tetrafluorobenzoic acid
InChI Key WTNSXWSOTDBWOR-UHFFFAOYSA-N
Molecular Formula C7H3F4NO2
9,437

2-Phenylbutyric Acid 98.0+%, TCI America™
SDP

CAS: 90-27-7 Molecular Formula: C10H12O2 Molecular Weight (g/mol): 164.204 MDL Number: MFCD00002667 InChI Key: OFJWFSNDPCAWDK-UHFFFAOYSA-N Synonym: 2-phenylbutyric acid,alpha-ethylphenylacetic acid,butyric acid, 2-phenyl,alpha-phenylbutyric acid,benzeneacetic acid, .alpha.-ethyl,alpha-phenyl butyric acid,2-phenylbutyricacid,benzeneacetic acid, alpha-ethyl,2-phenylburyric acid,alpha-toluic acid, alpha-ethyl PubChem CID: 7012 ChEBI: CHEBI:86545 IUPAC Name: 2-phenylbutanoic acid SMILES: CCC(C1=CC=CC=C1)C(=O)O

PubChem CID 7012
CAS 90-27-7
Molecular Weight (g/mol) 164.204
ChEBI CHEBI:86545
MDL Number MFCD00002667
SMILES CCC(C1=CC=CC=C1)C(=O)O
Synonym 2-phenylbutyric acid,alpha-ethylphenylacetic acid,butyric acid, 2-phenyl,alpha-phenylbutyric acid,benzeneacetic acid, .alpha.-ethyl,alpha-phenyl butyric acid,2-phenylbutyricacid,benzeneacetic acid, alpha-ethyl,2-phenylburyric acid,alpha-toluic acid, alpha-ethyl
IUPAC Name 2-phenylbutanoic acid
InChI Key OFJWFSNDPCAWDK-UHFFFAOYSA-N
Molecular Formula C10H12O2
9,438

Allylpentafluorobenzene 98.0+%, TCI America™
SDP

CAS: 1736-60-3 Molecular Formula: C9H5F5 Molecular Weight (g/mol): 208.13 MDL Number: MFCD00000301 InChI Key: YBDBTBVNQQBHGJ-UHFFFAOYSA-N Synonym: allylpentafluorobenzene,benzene, allylpentafluoro,3-pentafluorophenyl-1-propene,2,3,4,5,6-pentafluoro allylbenzene,benzene, pentafluoro-2-propenyl,1,2,3,4,5-pentafluoro-6-prop-2-en-1-yl benzene,allyl pentafluorobenzene,pubchem13366,acmc-1bth5 PubChem CID: 74435 IUPAC Name: 1,2,3,4,5-pentafluoro-6-(prop-2-en-1-yl)benzene SMILES: FC1=C(F)C(F)=C(CC=C)C(F)=C1F

PubChem CID 74435
CAS 1736-60-3
Molecular Weight (g/mol) 208.13
MDL Number MFCD00000301
SMILES FC1=C(F)C(F)=C(CC=C)C(F)=C1F
Synonym allylpentafluorobenzene,benzene, allylpentafluoro,3-pentafluorophenyl-1-propene,2,3,4,5,6-pentafluoro allylbenzene,benzene, pentafluoro-2-propenyl,1,2,3,4,5-pentafluoro-6-prop-2-en-1-yl benzene,allyl pentafluorobenzene,pubchem13366,acmc-1bth5
IUPAC Name 1,2,3,4,5-pentafluoro-6-(prop-2-en-1-yl)benzene
InChI Key YBDBTBVNQQBHGJ-UHFFFAOYSA-N
Molecular Formula C9H5F5
9,439

2-(Diphenylphosphino)benzoic Acid 98.0+%, TCI America™
SDP

CAS: 17261-28-8 Molecular Formula: C19H15O2P Molecular Weight (g/mol): 306.30 MDL Number: MFCD00674024 InChI Key: UYRPRYSDOVYCOU-UHFFFAOYSA-N Synonym: 2-diphenylphosphino benzoic acid,2-diphenylphosphinobenzoic acid,benzoic acid, 2-diphenylphosphino,o-diphenylphosphinobenozic acid,2-carboxyphenyl diphenylphosphine,2-diphenylphosphanyl benzoic acid,benzoic acid, diphenylphosphino,o-diphenylphosphino benzoic acid,dppbac,acmc-1bt7u PubChem CID: 87021 IUPAC Name: 2-(diphenylphosphanyl)benzoic acid SMILES: OC(=O)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1

PubChem CID 87021
CAS 17261-28-8
Molecular Weight (g/mol) 306.30
MDL Number MFCD00674024
SMILES OC(=O)C1=CC=CC=C1P(C1=CC=CC=C1)C1=CC=CC=C1
Synonym 2-diphenylphosphino benzoic acid,2-diphenylphosphinobenzoic acid,benzoic acid, 2-diphenylphosphino,o-diphenylphosphinobenozic acid,2-carboxyphenyl diphenylphosphine,2-diphenylphosphanyl benzoic acid,benzoic acid, diphenylphosphino,o-diphenylphosphino benzoic acid,dppbac,acmc-1bt7u
IUPAC Name 2-(diphenylphosphanyl)benzoic acid
InChI Key UYRPRYSDOVYCOU-UHFFFAOYSA-N
Molecular Formula C19H15O2P
9,440

4-Nitrophenyl Trifluoroacetate 98.0+%, TCI America™
SDP

CAS: 658-78-6 Molecular Formula: C8H4F3NO4 Molecular Weight (g/mol): 235.118 MDL Number: MFCD00007324 InChI Key: JFOIBTLTZWOAIC-UHFFFAOYSA-N Synonym: Trifluoroacetic Acid 4-Nitrophenyl Ester PubChem CID: 69569 IUPAC Name: (4-nitrophenyl) 2,2,2-trifluoroacetate SMILES: C1=CC(=CC=C1[N+](=O)[O-])OC(=O)C(F)(F)F

PubChem CID 69569
CAS 658-78-6
Molecular Weight (g/mol) 235.118
MDL Number MFCD00007324
SMILES C1=CC(=CC=C1[N+](=O)[O-])OC(=O)C(F)(F)F
Synonym Trifluoroacetic Acid 4-Nitrophenyl Ester
IUPAC Name (4-nitrophenyl) 2,2,2-trifluoroacetate
InChI Key JFOIBTLTZWOAIC-UHFFFAOYSA-N
Molecular Formula C8H4F3NO4
9,441

1-Bromo-4-fluoro-2-nitrobenzene 97.0+%, TCI America™
SDP

CAS: 446-09-3 Molecular Formula: C6H3BrFNO2 Molecular Weight (g/mol): 219.997 MDL Number: MFCD00055530 InChI Key: XRXNWKIKQFEOGO-UHFFFAOYSA-N Synonym: 2-bromo-5-fluoronitrobenzene,benzene, 1-bromo-4-fluoro-2-nitro,2-bromo-5-fluoro-nitrobenzene,pubchem1044,acmc-1ajt6,ksc494a1j,2-nitro-4-fluoro-bromobenzene,xrxnwkikqfeogo-uhfffaoysa,2-bromo-5-fluoro nitro benzene,1-bromo-2-nitro-4-fluorobenzene PubChem CID: 2773383 IUPAC Name: 1-bromo-4-fluoro-2-nitrobenzene SMILES: C1=CC(=C(C=C1F)[N+](=O)[O-])Br

PubChem CID 2773383
CAS 446-09-3
Molecular Weight (g/mol) 219.997
MDL Number MFCD00055530
SMILES C1=CC(=C(C=C1F)[N+](=O)[O-])Br
Synonym 2-bromo-5-fluoronitrobenzene,benzene, 1-bromo-4-fluoro-2-nitro,2-bromo-5-fluoro-nitrobenzene,pubchem1044,acmc-1ajt6,ksc494a1j,2-nitro-4-fluoro-bromobenzene,xrxnwkikqfeogo-uhfffaoysa,2-bromo-5-fluoro nitro benzene,1-bromo-2-nitro-4-fluorobenzene
IUPAC Name 1-bromo-4-fluoro-2-nitrobenzene
InChI Key XRXNWKIKQFEOGO-UHFFFAOYSA-N
Molecular Formula C6H3BrFNO2
9,442

Isorhapontigenin 96.0+%, TCI America™
SDP

CAS: 32507-66-7 Molecular Formula: C15H14O4 Molecular Weight (g/mol): 258.273 MDL Number: MFCD12407151 InChI Key: ANNNBEZJTNCXHY-NSCUHMNNSA-N Synonym: 3,4′C,5-Trihydroxy-3′C-methoxy-trans-stilbene PubChem CID: 5318650 IUPAC Name: 5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diol SMILES: COC1=C(C=CC(=C1)C=CC2=CC(=CC(=C2)O)O)O

PubChem CID 5318650
CAS 32507-66-7
Molecular Weight (g/mol) 258.273
MDL Number MFCD12407151
SMILES COC1=C(C=CC(=C1)C=CC2=CC(=CC(=C2)O)O)O
Synonym 3,4′C,5-Trihydroxy-3′C-methoxy-trans-stilbene
IUPAC Name 5-[(E)-2-(4-hydroxy-3-methoxyphenyl)ethenyl]benzene-1,3-diol
InChI Key ANNNBEZJTNCXHY-NSCUHMNNSA-N
Molecular Formula C15H14O4
9,443

2-Chlorobenzenethiol 97.0+%, TCI America™
SDP

CAS: 6320-03-2 Molecular Formula: C6H5ClS Molecular Weight (g/mol): 144.62 InChI Key: PWOBDMNCYMQTCE-UHFFFAOYSA-N Synonym: 2-chlorothiophenol,o-chlorothiophenol,benzenethiol, 2-chloro,1-chloro-2-mercaptobenzene,o-chlorobenzenethiol,o-chloromercaptobenzene,chlorothiophenol,benzenethiol, o-chloro,2-chlorobenzene-1-thiol,2-chloro thiophenol PubChem CID: 80599 IUPAC Name: 2-chlorobenzenethiol SMILES: C1=CC=C(C(=C1)S)Cl

PubChem CID 80599
CAS 6320-03-2
Molecular Weight (g/mol) 144.62
SMILES C1=CC=C(C(=C1)S)Cl
Synonym 2-chlorothiophenol,o-chlorothiophenol,benzenethiol, 2-chloro,1-chloro-2-mercaptobenzene,o-chlorobenzenethiol,o-chloromercaptobenzene,chlorothiophenol,benzenethiol, o-chloro,2-chlorobenzene-1-thiol,2-chloro thiophenol
IUPAC Name 2-chlorobenzenethiol
InChI Key PWOBDMNCYMQTCE-UHFFFAOYSA-N
Molecular Formula C6H5ClS
9,444

2-Ethylhexyl 4-Hydroxybenzoate 98.0+%, TCI America™
SDP

CAS: 5153-25-3 Molecular Formula: C15H22O3 Molecular Weight (g/mol): 250.338 MDL Number: MFCD00016472 InChI Key: VTIMKVIDORQQFA-UHFFFAOYSA-N Synonym: 2-Ethylhexylparaben, 4-Hydroxybenzoic Acid 2-Ethylhexyl Ester, 4-Hydroxybenzoic Acid Octyl Ester, Octyl 4-Hydroxybenzoate, Octylparaben PubChem CID: 107377 ChEBI: CHEBI:34274 IUPAC Name: 2-ethylhexyl 4-hydroxybenzoate SMILES: CCCCC(CC)COC(=O)C1=CC=C(C=C1)O

PubChem CID 107377
CAS 5153-25-3
Molecular Weight (g/mol) 250.338
ChEBI CHEBI:34274
MDL Number MFCD00016472
SMILES CCCCC(CC)COC(=O)C1=CC=C(C=C1)O
Synonym 2-Ethylhexylparaben, 4-Hydroxybenzoic Acid 2-Ethylhexyl Ester, 4-Hydroxybenzoic Acid Octyl Ester, Octyl 4-Hydroxybenzoate, Octylparaben
IUPAC Name 2-ethylhexyl 4-hydroxybenzoate
InChI Key VTIMKVIDORQQFA-UHFFFAOYSA-N
Molecular Formula C15H22O3
9,445

trans-beta-Methylstyrene (stabilized with TBC) 97.0+%, TCI America™
SDP

CAS: 873-66-5 Molecular Formula: C9H10 Molecular Weight (g/mol): 118.179 MDL Number: MFCD00009280 InChI Key: QROGIFZRVHSFLM-QHHAFSJGSA-N Synonym: beta-methylstyrene,trans-beta-methylstyrene,1-phenylpropene,isoallylbenzene,propenylbenzene,trans-1-phenyl-1-propene,1-propenylbenzene,trans-propenylbenzene,1-phenyl-1-propene,benzene, 1-propenyl PubChem CID: 252325 IUPAC Name: [(E)-prop-1-enyl]benzene SMILES: CC=CC1=CC=CC=C1

PubChem CID 252325
CAS 873-66-5
Molecular Weight (g/mol) 118.179
MDL Number MFCD00009280
SMILES CC=CC1=CC=CC=C1
Synonym beta-methylstyrene,trans-beta-methylstyrene,1-phenylpropene,isoallylbenzene,propenylbenzene,trans-1-phenyl-1-propene,1-propenylbenzene,trans-propenylbenzene,1-phenyl-1-propene,benzene, 1-propenyl
IUPAC Name [(E)-prop-1-enyl]benzene
InChI Key QROGIFZRVHSFLM-QHHAFSJGSA-N
Molecular Formula C9H10
9,446

Resorcinol 99.0+%, TCI America™
SDP

CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: 1,3-Dihydroxybenzene PubChem CID: 5054 ChEBI: CHEBI:27810 IUPAC Name: benzene-1,3-diol SMILES: C1=CC(=CC(=C1)O)O

PubChem CID 5054
CAS 108-46-3
Molecular Weight (g/mol) 110.112
ChEBI CHEBI:27810
MDL Number MFCD00002269
SMILES C1=CC(=CC(=C1)O)O
Synonym 1,3-Dihydroxybenzene
IUPAC Name benzene-1,3-diol
InChI Key GHMLBKRAJCXXBS-UHFFFAOYSA-N
Molecular Formula C6H6O2
9,447

1,8-Bis(diphenylphosphino)naphthalene 97.0+%, TCI America™
SDP

CAS: 153725-04-3 Molecular Formula: C34H26P2 Molecular Weight (g/mol): 496.53 MDL Number: MFCD04117326 InChI Key: QOXZKPURCFVBRR-UHFFFAOYSA-N PubChem CID: 2756729 IUPAC Name: [8-(diphenylphosphanyl)naphthalen-1-yl]diphenylphosphane SMILES: C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C12

PubChem CID 2756729
CAS 153725-04-3
Molecular Weight (g/mol) 496.53
MDL Number MFCD04117326
SMILES C1=CC=C(C=C1)P(C1=CC=CC=C1)C1=CC=CC2=CC=CC(P(C3=CC=CC=C3)C3=CC=CC=C3)=C12
IUPAC Name [8-(diphenylphosphanyl)naphthalen-1-yl]diphenylphosphane
InChI Key QOXZKPURCFVBRR-UHFFFAOYSA-N
Molecular Formula C34H26P2
9,448

5-Chlorosalicylanilide 98.0+%, TCI America™
SDP

CAS: 4638-48-6 Molecular Formula: C13H10ClNO2 Molecular Weight (g/mol): 247.678 MDL Number: MFCD00002320 InChI Key: KGYNGVVNFRUOOZ-UHFFFAOYSA-N PubChem CID: 14869 IUPAC Name: 5-chloro-2-hydroxy-N-phenylbenzamide SMILES: C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Cl)O

PubChem CID 14869
CAS 4638-48-6
Molecular Weight (g/mol) 247.678
MDL Number MFCD00002320
SMILES C1=CC=C(C=C1)NC(=O)C2=C(C=CC(=C2)Cl)O
IUPAC Name 5-chloro-2-hydroxy-N-phenylbenzamide
InChI Key KGYNGVVNFRUOOZ-UHFFFAOYSA-N
Molecular Formula C13H10ClNO2
9,449

3,6-Bis(chloromethyl)durene 98.0+%, TCI America™
SDP

CAS: 3022-16-0 Molecular Formula: C12H16Cl2 Molecular Weight (g/mol): 231.16 MDL Number: MFCD00018883 InChI Key: PGFAKOSRZYDFLR-UHFFFAOYSA-N Synonym: 1,4-Bis(chloromethyl)-2,3,5,6-tetramethylbenzene PubChem CID: 76402 IUPAC Name: 1,4-bis(chloromethyl)-2,3,5,6-tetramethylbenzene SMILES: CC1=C(C(=C(C(=C1CCl)C)C)CCl)C

PubChem CID 76402
CAS 3022-16-0
Molecular Weight (g/mol) 231.16
MDL Number MFCD00018883
SMILES CC1=C(C(=C(C(=C1CCl)C)C)CCl)C
Synonym 1,4-Bis(chloromethyl)-2,3,5,6-tetramethylbenzene
IUPAC Name 1,4-bis(chloromethyl)-2,3,5,6-tetramethylbenzene
InChI Key PGFAKOSRZYDFLR-UHFFFAOYSA-N
Molecular Formula C12H16Cl2
9,450

Pentafluorophenyl Trifluoromethanesulfonate 97.0+%, TCI America™
SDP

CAS: 60129-85-3 Molecular Formula: C7F8O3S Molecular Weight (g/mol): 316.121 MDL Number: MFCD07784319 InChI Key: OTTBRWDUQHDNBY-UHFFFAOYSA-N Synonym: Trifluoromethanesulfonic Acid Pentafluorophenyl Ester, Pentafluorophenyl Triflate PubChem CID: 10041425 IUPAC Name: (2,3,4,5,6-pentafluorophenyl) trifluoromethanesulfonate SMILES: C1(=C(C(=C(C(=C1F)F)F)F)F)OS(=O)(=O)C(F)(F)F

PubChem CID 10041425
CAS 60129-85-3
Molecular Weight (g/mol) 316.121
MDL Number MFCD07784319
SMILES C1(=C(C(=C(C(=C1F)F)F)F)F)OS(=O)(=O)C(F)(F)F
Synonym Trifluoromethanesulfonic Acid Pentafluorophenyl Ester, Pentafluorophenyl Triflate
IUPAC Name (2,3,4,5,6-pentafluorophenyl) trifluoromethanesulfonate
InChI Key OTTBRWDUQHDNBY-UHFFFAOYSA-N
Molecular Formula C7F8O3S