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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)
Phenols (25,097)
Naphthalenes (6,366)
Phenol esters (4,814)
Unsubstituted Phenols (1,453)
Fluorenes (1,280)
Thiophenols (762)
Anthracenes (515)
Indanes (488)
Phenanthrenes and derivatives (364)
Tetralins (337)
Triphenyl compounds (278)
Pyrenes (277)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (16)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (6)

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3,316 – 3,330 of 159,106 results
3,316
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Benzoic anhydride, 98%

CAS: 93-97-0 Molecular Formula: C14H10O3 Molecular Weight (g/mol): 226.23 MDL Number: MFCD00003073 InChI Key: CHIHQLCVLOXUJW-UHFFFAOYSA-N Synonym: benzoic anhydride,benzoic acid, anhydride,benzoyl anhydride,benzoylbenzoate,benzoic acid anhydride,benzoic acid, 1,1'-anhydride,phenyl anhydride,benzoesaeureanhydrid,unii-9k7x34fov2,phenylcarbonyl benzoate PubChem CID: 7167 ChEBI: CHEBI:38815 IUPAC Name: benzoyl benzoate SMILES: C1=CC=C(C=C1)C(=O)OC(=O)C2=CC=CC=C2

PubChem CID 7167
CAS 93-97-0
Molecular Weight (g/mol) 226.23
ChEBI CHEBI:38815
MDL Number MFCD00003073
SMILES C1=CC=C(C=C1)C(=O)OC(=O)C2=CC=CC=C2
Synonym benzoic anhydride,benzoic acid, anhydride,benzoyl anhydride,benzoylbenzoate,benzoic acid anhydride,benzoic acid, 1,1'-anhydride,phenyl anhydride,benzoesaeureanhydrid,unii-9k7x34fov2,phenylcarbonyl benzoate
IUPAC Name benzoyl benzoate
InChI Key CHIHQLCVLOXUJW-UHFFFAOYSA-N
Molecular Formula C14H10O3
3,317
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1,4-Benzenedithiol, 97%

CAS: 624-39-5 Molecular Formula: C6H6S2 Molecular Weight (g/mol): 142.23 MDL Number: MFCD00142541 InChI Key: WYLQRHZSKIDFEP-UHFFFAOYSA-N Synonym: 1,4-benzenedithiol,dithiohydroquinone,1,4-dimercaptobenzene,4-mercaptothiophenol,1,4-benzene dithiol,pubchem6866,acmc-1b45q,benzene-1,4-dithiol gc PubChem CID: 4691729 IUPAC Name: benzene-1,4-dithiol SMILES: SC1=CC=C(S)C=C1

PubChem CID 4691729
CAS 624-39-5
Molecular Weight (g/mol) 142.23
MDL Number MFCD00142541
SMILES SC1=CC=C(S)C=C1
Synonym 1,4-benzenedithiol,dithiohydroquinone,1,4-dimercaptobenzene,4-mercaptothiophenol,1,4-benzene dithiol,pubchem6866,acmc-1b45q,benzene-1,4-dithiol gc
IUPAC Name benzene-1,4-dithiol
InChI Key WYLQRHZSKIDFEP-UHFFFAOYSA-N
Molecular Formula C6H6S2
3,318
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3-chlorobenzaldehyde, 99%

CAS: 587-04-2 Molecular Formula: C7H5ClO Molecular Weight (g/mol): 140.57 MDL Number: MFCD00003350 InChI Key: SRWILAKSARHZPR-UHFFFAOYSA-N Synonym: m-chlorobenzaldehyde,benzaldehyde, 3-chloro,mcad,meta-chlorobenzaldehyde,benzaldehyde, m-chloro,3-chloro benzaldehyde,3-chloro-benzaldehyde,benzaldehyde, 3-chloro-9ci,ccris 8613,3-chiorobenzaldehyde PubChem CID: 11477 IUPAC Name: 3-chlorobenzaldehyde SMILES: C1=CC(=CC(=C1)Cl)C=O

PubChem CID 11477
CAS 587-04-2
Molecular Weight (g/mol) 140.57
MDL Number MFCD00003350
SMILES C1=CC(=CC(=C1)Cl)C=O
Synonym m-chlorobenzaldehyde,benzaldehyde, 3-chloro,mcad,meta-chlorobenzaldehyde,benzaldehyde, m-chloro,3-chloro benzaldehyde,3-chloro-benzaldehyde,benzaldehyde, 3-chloro-9ci,ccris 8613,3-chiorobenzaldehyde
IUPAC Name 3-chlorobenzaldehyde
InChI Key SRWILAKSARHZPR-UHFFFAOYSA-N
Molecular Formula C7H5ClO
3,319
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2,6-Di-tert-butylphenol, 99%

CAS: 128-39-2 Molecular Formula: C14H22O Molecular Weight (g/mol): 206.33 MDL Number: MFCD00008820 InChI Key: DKCPKDPYUFEZCP-UHFFFAOYSA-N Synonym: 2,6-di-tert-butylphenol,2,6-di-t-butylphenol,2,6-bis tert-butyl phenol,2,6-bis 1,1-dimethylethyl phenol,phenol, 2,6-bis 1,1-dimethylethyl,2,6 di-tert-butylphenol,ethanox 701,isonox 103,ethyl 701,ethyl an 701 PubChem CID: 31405 IUPAC Name: 2,6-ditert-butylphenol SMILES: CC(C)(C)C1=CC=CC(=C1O)C(C)(C)C

PubChem CID 31405
CAS 128-39-2
Molecular Weight (g/mol) 206.33
MDL Number MFCD00008820
SMILES CC(C)(C)C1=CC=CC(=C1O)C(C)(C)C
Synonym 2,6-di-tert-butylphenol,2,6-di-t-butylphenol,2,6-bis tert-butyl phenol,2,6-bis 1,1-dimethylethyl phenol,phenol, 2,6-bis 1,1-dimethylethyl,2,6 di-tert-butylphenol,ethanox 701,isonox 103,ethyl 701,ethyl an 701
IUPAC Name 2,6-ditert-butylphenol
InChI Key DKCPKDPYUFEZCP-UHFFFAOYSA-N
Molecular Formula C14H22O
3,320
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4-(Benzyloxy)phenol, 98%

CAS: 103-16-2 Molecular Formula: C13H12O2 Molecular Weight (g/mol): 200.24 MDL Number: MFCD00002333 InChI Key: VYQNWZOUAUKGHI-UHFFFAOYSA-N Synonym: 4-benzyloxyphenol,monobenzone,4-benzyloxy phenol,hydroquinone monobenzyl ether,benoquin,benzoquin,superlite,monobenzyl hydroquinone,leucodinine,monobenzon PubChem CID: 7638 ChEBI: CHEBI:34380 IUPAC Name: 4-phenylmethoxyphenol SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)O

PubChem CID 7638
CAS 103-16-2
Molecular Weight (g/mol) 200.24
ChEBI CHEBI:34380
MDL Number MFCD00002333
SMILES C1=CC=C(C=C1)COC2=CC=C(C=C2)O
Synonym 4-benzyloxyphenol,monobenzone,4-benzyloxy phenol,hydroquinone monobenzyl ether,benoquin,benzoquin,superlite,monobenzyl hydroquinone,leucodinine,monobenzon
IUPAC Name 4-phenylmethoxyphenol
InChI Key VYQNWZOUAUKGHI-UHFFFAOYSA-N
Molecular Formula C13H12O2
3,321
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4-Hydroxy-3-methoxybenzyl alcohol, 99%

CAS: 498-00-0 Molecular Formula: C8H10O3 Molecular Weight (g/mol): 154.17 MDL Number: MFCD00004659 InChI Key: ZENOXNGFMSCLLL-UHFFFAOYSA-N Synonym: vanillyl alcohol,4-hydroxy-3-methoxybenzyl alcohol,4-hydroxymethyl-2-methoxyphenol,vanillin alcohol,vanillic alcohol,4-hydroxy-3-methoxybenzenemethanol,benzenemethanol, 4-hydroxy-3-methoxy,vanillol,4-hydroxy-3-methoxybenzylalcohol,4-hydroxy-3-methoxyphenylmethanol PubChem CID: 62348 ChEBI: CHEBI:18353 IUPAC Name: 4-(hydroxymethyl)-2-methoxyphenol SMILES: COC1=CC(CO)=CC=C1O

PubChem CID 62348
CAS 498-00-0
Molecular Weight (g/mol) 154.17
ChEBI CHEBI:18353
MDL Number MFCD00004659
SMILES COC1=CC(CO)=CC=C1O
Synonym vanillyl alcohol,4-hydroxy-3-methoxybenzyl alcohol,4-hydroxymethyl-2-methoxyphenol,vanillin alcohol,vanillic alcohol,4-hydroxy-3-methoxybenzenemethanol,benzenemethanol, 4-hydroxy-3-methoxy,vanillol,4-hydroxy-3-methoxybenzylalcohol,4-hydroxy-3-methoxyphenylmethanol
IUPAC Name 4-(hydroxymethyl)-2-methoxyphenol
InChI Key ZENOXNGFMSCLLL-UHFFFAOYSA-N
Molecular Formula C8H10O3
3,322
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4-Bromobenzaldehyde, 99%

CAS: 1122-91-4 Molecular Formula: C7H5BrO Molecular Weight (g/mol): 185.02 InChI Key: ZRYZBQLXDKPBDU-UHFFFAOYSA-N Synonym: p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd PubChem CID: 70741 IUPAC Name: 4-bromobenzaldehyde SMILES: C1=CC(=CC=C1C=O)Br

PubChem CID 70741
CAS 1122-91-4
Molecular Weight (g/mol) 185.02
SMILES C1=CC(=CC=C1C=O)Br
Synonym p-bromobenzaldehyde,benzaldehyde, 4-bromo,benzaldehyde, p-bromo,4-bromo-benzaldehyde,4-bromo benzaldehyde,4-bromobenzylaldehyde,p-bromo benzaldehyde,unii-4l8vm24f65,4-brombenzaldehyde,4-brombenzaldehyd
IUPAC Name 4-bromobenzaldehyde
InChI Key ZRYZBQLXDKPBDU-UHFFFAOYSA-N
Molecular Formula C7H5BrO
3,323
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2-Aminophenol, 99%

CAS: 95-55-6 Molecular Formula: C6H7NO Molecular Weight (g/mol): 109.13 MDL Number: MFCD00007690 InChI Key: CDAWCLOXVUBKRW-UHFFFAOYSA-N Synonym: o-aminophenol,o-hydroxyaniline,2-hydroxyaniline,phenol, 2-amino,2-amino-1-hydroxybenzene,fouramine op,benzofur gg,pelagol grey gg,pelagol 3ga,nako yellow 3ga PubChem CID: 5801 ChEBI: CHEBI:18112 IUPAC Name: 2-aminophenol SMILES: C1=CC=C(C(=C1)N)O

PubChem CID 5801
CAS 95-55-6
Molecular Weight (g/mol) 109.13
ChEBI CHEBI:18112
MDL Number MFCD00007690
SMILES C1=CC=C(C(=C1)N)O
Synonym o-aminophenol,o-hydroxyaniline,2-hydroxyaniline,phenol, 2-amino,2-amino-1-hydroxybenzene,fouramine op,benzofur gg,pelagol grey gg,pelagol 3ga,nako yellow 3ga
IUPAC Name 2-aminophenol
InChI Key CDAWCLOXVUBKRW-UHFFFAOYSA-N
Molecular Formula C6H7NO
3,324
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4-Aminophenyl ether, 98%

CAS: 101-80-4 Molecular Formula: C12H12N2O Molecular Weight (g/mol): 200.24 InChI Key: HLBLWEWZXPIGSM-UHFFFAOYSA-N Synonym: 4,4'-oxydianiline,4,4'-diaminodiphenyl ether,4,4-oxydianiline,4-aminophenyl ether,4,4'-oxybisbenzenamine,oxydianiline,4-4-aminophenoxy aniline,diaminodiphenyl ether,benzenamine, 4,4'-oxybis,p,p'-oxydianiline PubChem CID: 7579 ChEBI: CHEBI:34384 IUPAC Name: 4-(4-aminophenoxy)aniline SMILES: C1=CC(=CC=C1N)OC2=CC=C(C=C2)N

PubChem CID 7579
CAS 101-80-4
Molecular Weight (g/mol) 200.24
ChEBI CHEBI:34384
SMILES C1=CC(=CC=C1N)OC2=CC=C(C=C2)N
Synonym 4,4'-oxydianiline,4,4'-diaminodiphenyl ether,4,4-oxydianiline,4-aminophenyl ether,4,4'-oxybisbenzenamine,oxydianiline,4-4-aminophenoxy aniline,diaminodiphenyl ether,benzenamine, 4,4'-oxybis,p,p'-oxydianiline
IUPAC Name 4-(4-aminophenoxy)aniline
InChI Key HLBLWEWZXPIGSM-UHFFFAOYSA-N
Molecular Formula C12H12N2O
3,325
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4-Chlorobenzotrifluoride, 98%

CAS: 98-56-6 Molecular Formula: C7H4ClF3 Molecular Weight (g/mol): 180.56 MDL Number: MFCD00000627 InChI Key: QULYNCCPRWKEMF-UHFFFAOYSA-N Synonym: 4-chlorobenzotrifluoride,p-chlorobenzotrifluoride,1-chloro-4-trifluoromethyl benzene,benzene, 1-chloro-4-trifluoromethyl,4-chloro-alpha,alpha,alpha-trifluorotoluene,para-chlorobenzotrifluoride,p-chlorophenyl trifluoromethane,p-chloro-a,a,a-trifluorotoluene,pcbtf,p-chlorotrifluoromethylbenzene PubChem CID: 7394 IUPAC Name: 1-chloro-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1C(F)(F)F)Cl

PubChem CID 7394
CAS 98-56-6
Molecular Weight (g/mol) 180.56
MDL Number MFCD00000627
SMILES C1=CC(=CC=C1C(F)(F)F)Cl
Synonym 4-chlorobenzotrifluoride,p-chlorobenzotrifluoride,1-chloro-4-trifluoromethyl benzene,benzene, 1-chloro-4-trifluoromethyl,4-chloro-alpha,alpha,alpha-trifluorotoluene,para-chlorobenzotrifluoride,p-chlorophenyl trifluoromethane,p-chloro-a,a,a-trifluorotoluene,pcbtf,p-chlorotrifluoromethylbenzene
IUPAC Name 1-chloro-4-(trifluoromethyl)benzene
InChI Key QULYNCCPRWKEMF-UHFFFAOYSA-N
Molecular Formula C7H4ClF3
3,326
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Cinnamonitrile, 97%, predominantly trans

CAS: 1885-38-7 Molecular Formula: C9H7N Molecular Weight (g/mol): 129.16 MDL Number: MFCD00001930 InChI Key: ZWKNLRXFUTWSOY-QPJJXVBHSA-N Synonym: cinnamonitrile,trans-cinnamonitrile,styryl cyanide,cinnamyl nitrile,3-phenylacrylonitrile,beta-cyanostyrene,cinnamonitrile, e,3-phenyl-2-propenenitrile,acrylonitrile, 3-phenyl,e-3-phenylprop-2-enenitrile PubChem CID: 1550846 IUPAC Name: (E)-3-phenylprop-2-enenitrile SMILES: C1=CC=C(C=C1)C=CC#N

PubChem CID 1550846
CAS 1885-38-7
Molecular Weight (g/mol) 129.16
MDL Number MFCD00001930
SMILES C1=CC=C(C=C1)C=CC#N
Synonym cinnamonitrile,trans-cinnamonitrile,styryl cyanide,cinnamyl nitrile,3-phenylacrylonitrile,beta-cyanostyrene,cinnamonitrile, e,3-phenyl-2-propenenitrile,acrylonitrile, 3-phenyl,e-3-phenylprop-2-enenitrile
IUPAC Name (E)-3-phenylprop-2-enenitrile
InChI Key ZWKNLRXFUTWSOY-QPJJXVBHSA-N
Molecular Formula C9H7N
3,327
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4-Chloro-3-nitrobenzotrifluoride, 98%, Thermo Scientific™

CAS: 121-17-5 Molecular Formula: C7H3ClF3NO2 Molecular Weight (g/mol): 225.55 MDL Number: MFCD00007084 InChI Key: TZGFQIXRVUHDLE-UHFFFAOYSA-N Synonym: 4-chloro-3-nitrobenzotrifluoride,1-chloro-2-nitro-4-trifluoromethyl benzene,3-nitro-4-chlorobenzotrifluoride,2-chloro-5-trifluoromethyl nitrobenzene,benzene, 1-chloro-2-nitro-4-trifluoromethyl,cmnt,2-nitro-4-trifluoromethylchlorobenzene,3-nitro-4-chlorotrifluoromethylbenzene,4-chloro-3-nitro-a,a,a-trifluorotoluene,4-chloro-3-nitrobenzylidyne fluoride PubChem CID: 8462 IUPAC Name: 1-chloro-2-nitro-4-(trifluoromethyl)benzene SMILES: [O-][N+](=O)C1=CC(=CC=C1Cl)C(F)(F)F

PubChem CID 8462
CAS 121-17-5
Molecular Weight (g/mol) 225.55
MDL Number MFCD00007084
SMILES [O-][N+](=O)C1=CC(=CC=C1Cl)C(F)(F)F
Synonym 4-chloro-3-nitrobenzotrifluoride,1-chloro-2-nitro-4-trifluoromethyl benzene,3-nitro-4-chlorobenzotrifluoride,2-chloro-5-trifluoromethyl nitrobenzene,benzene, 1-chloro-2-nitro-4-trifluoromethyl,cmnt,2-nitro-4-trifluoromethylchlorobenzene,3-nitro-4-chlorotrifluoromethylbenzene,4-chloro-3-nitro-a,a,a-trifluorotoluene,4-chloro-3-nitrobenzylidyne fluoride
IUPAC Name 1-chloro-2-nitro-4-(trifluoromethyl)benzene
InChI Key TZGFQIXRVUHDLE-UHFFFAOYSA-N
Molecular Formula C7H3ClF3NO2
3,328
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1,1-Dichlorodimethyl ether, 97%

CAS: 4885-02-3 Molecular Formula: C2H4Cl2O Molecular Weight (g/mol): 114.96 MDL Number: MFCD00000828 InChI Key: GRTGGSXWHGKRSB-UHFFFAOYSA-N SMILES: COC(Cl)Cl

CAS 4885-02-3
Molecular Weight (g/mol) 114.96
MDL Number MFCD00000828
SMILES COC(Cl)Cl
InChI Key GRTGGSXWHGKRSB-UHFFFAOYSA-N
Molecular Formula C2H4Cl2O
3,329

Ethyl Benzoate, 99+%

CAS: 93-89-0 Molecular Formula: C9H10O2 Molecular Weight (g/mol): 150.18 MDL Number: MFCD00009109 InChI Key: MTZQAGJQAFMTAQ-UHFFFAOYSA-N Synonym: benzoic acid, ethyl ester,benzoic ether,ethyl benzenecarboxylate,ethylbenzoate,benzoyl ethyl ether,benzoic acid ethyl ester,ethylester kyseliny benzoove,natural,unii-j115brj15h,fema no. 2422 PubChem CID: 7165 IUPAC Name: ethyl benzoate SMILES: CCOC(=O)C1=CC=CC=C1

PubChem CID 7165
CAS 93-89-0
Molecular Weight (g/mol) 150.18
MDL Number MFCD00009109
SMILES CCOC(=O)C1=CC=CC=C1
Synonym benzoic acid, ethyl ester,benzoic ether,ethyl benzenecarboxylate,ethylbenzoate,benzoyl ethyl ether,benzoic acid ethyl ester,ethylester kyseliny benzoove,natural,unii-j115brj15h,fema no. 2422
IUPAC Name ethyl benzoate
InChI Key MTZQAGJQAFMTAQ-UHFFFAOYSA-N
Molecular Formula C9H10O2
3,330

Probucol, MP Biomedicals™

CAS: 23288-49-5 Molecular Formula: C31H48O2S2 Molecular Weight (g/mol): 516.843 InChI Key: FYPMFJGVHOHGLL-UHFFFAOYSA-N Synonym: probucol,lorelco,biphenabid,bisphenabid,lurselle,bisbid,lesterol,lursell,panavir,probucolum PubChem CID: 4912 ChEBI: CHEBI:8427 IUPAC Name: 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol SMILES: CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C

PubChem CID 4912
CAS 23288-49-5
Molecular Weight (g/mol) 516.843
ChEBI CHEBI:8427
SMILES CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)SC(C)(C)SC2=CC(=C(C(=C2)C(C)(C)C)O)C(C)(C)C
Synonym probucol,lorelco,biphenabid,bisphenabid,lurselle,bisbid,lesterol,lursell,panavir,probucolum
IUPAC Name 2,6-ditert-butyl-4-[2-(3,5-ditert-butyl-4-hydroxyphenyl)sulfanylpropan-2-ylsulfanyl]phenol
InChI Key FYPMFJGVHOHGLL-UHFFFAOYSA-N
Molecular Formula C31H48O2S2