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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 (67,378)
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Naphthalenes (5,013)
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Unsubstituted Phenols (1,165)
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Phenol esters (473)
Anthracenes (408)
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Phenanthrenes and derivatives (327)
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1-hydroxylamino 2-unsubstituted benzenoids (5)

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2,656 – 2,670 of 78,024 results
2,656

3,3',5,5'-Tetramethylbenzidine dihydrochloride hydrate, 98+%

CAS: 207738-08-7 Molecular Formula: C16H22Cl2N2 Molecular Weight (g/mol): 313.27 MDL Number: MFCD00150104 InChI Key: NYNRGZULARUZCC-UHFFFAOYSA-N Synonym: 3,3',5,5'-tetramethylbenzidine dihydrochloride dihydrate,3,3',5,5'-tetramethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride dihydrate,3,3',5,5'-tetramethylbenzidine dihydrochloride hydrate,pubchem9044,tetramethylbenzidine dihydrate dihydrochloride PubChem CID: 19836601 IUPAC Name: 4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline;dihydrate;dihydrochloride SMILES: Cl.Cl.CC1=CC(=CC(C)=C1N)C1=CC(C)=C(N)C(C)=C1

PubChem CID 19836601
CAS 207738-08-7
Molecular Weight (g/mol) 313.27
MDL Number MFCD00150104
SMILES Cl.Cl.CC1=CC(=CC(C)=C1N)C1=CC(C)=C(N)C(C)=C1
Synonym 3,3',5,5'-tetramethylbenzidine dihydrochloride dihydrate,3,3',5,5'-tetramethyl-1,1'-biphenyl-4,4'-diamine dihydrochloride dihydrate,3,3',5,5'-tetramethylbenzidine dihydrochloride hydrate,pubchem9044,tetramethylbenzidine dihydrate dihydrochloride
IUPAC Name 4-(4-amino-3,5-dimethylphenyl)-2,6-dimethylaniline;dihydrate;dihydrochloride
InChI Key NYNRGZULARUZCC-UHFFFAOYSA-N
Molecular Formula C16H22Cl2N2
2,657

2-Bromobiphenyl, 98%

CAS: 2052-07-5 Molecular Formula: C12H9Br Molecular Weight (g/mol): 233.11 MDL Number: MFCD00000065 InChI Key: KTADSLDAUJLZGL-UHFFFAOYSA-N Synonym: 2-bromobiphenyl,o-bromobiphenyl,2-bromo-biphenyl,1,1'-biphenyl, 2-bromo,2-bromo-1,1'-biphenyl,biphenyl, 2-bromo,2-bromo-diphenyl,bromobiphenyl,2-bromodiphenyl,1,1'-biphenyl, bromo PubChem CID: 16329 IUPAC Name: 1-bromo-2-phenylbenzene SMILES: C1=CC=C(C=C1)C2=CC=CC=C2Br

PubChem CID 16329
CAS 2052-07-5
Molecular Weight (g/mol) 233.11
MDL Number MFCD00000065
SMILES C1=CC=C(C=C1)C2=CC=CC=C2Br
Synonym 2-bromobiphenyl,o-bromobiphenyl,2-bromo-biphenyl,1,1'-biphenyl, 2-bromo,2-bromo-1,1'-biphenyl,biphenyl, 2-bromo,2-bromo-diphenyl,bromobiphenyl,2-bromodiphenyl,1,1'-biphenyl, bromo
IUPAC Name 1-bromo-2-phenylbenzene
InChI Key KTADSLDAUJLZGL-UHFFFAOYSA-N
Molecular Formula C12H9Br
2,658

4-Cyano-4'-n-pentylbiphenyl, 99%

CAS: 40817-08-1 Molecular Formula: C18H19N Molecular Weight (g/mol): 249.357 MDL Number: MFCD00036350 InChI Key: HHPCNRKYVYWYAU-UHFFFAOYSA-N Synonym: 4-cyano-4'-pentylbiphenyl,4'-pentyl-1,1'-biphenyl-4-carbonitrile,4-cyano-4'-n-pentylbiphenyl,1,1'-biphenyl-4-carbonitrile, 4'-pentyl,4'-pentyl-4-biphenylcarbonitrile,4-pentyl-4'-cyanobiphenyl,4'-amyl-4-biphenylcarbonitrile,4'-pentylbiphenyl-4-carbonitrile,4-amyl-4'-cyanobiphenyl,4-n-pentyl-4'-cyanobiphenyl PubChem CID: 92319 IUPAC Name: 4-(4-pentylphenyl)benzonitrile SMILES: CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

PubChem CID 92319
CAS 40817-08-1
Molecular Weight (g/mol) 249.357
MDL Number MFCD00036350
SMILES CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
Synonym 4-cyano-4'-pentylbiphenyl,4'-pentyl-1,1'-biphenyl-4-carbonitrile,4-cyano-4'-n-pentylbiphenyl,1,1'-biphenyl-4-carbonitrile, 4'-pentyl,4'-pentyl-4-biphenylcarbonitrile,4-pentyl-4'-cyanobiphenyl,4'-amyl-4-biphenylcarbonitrile,4'-pentylbiphenyl-4-carbonitrile,4-amyl-4'-cyanobiphenyl,4-n-pentyl-4'-cyanobiphenyl
IUPAC Name 4-(4-pentylphenyl)benzonitrile
InChI Key HHPCNRKYVYWYAU-UHFFFAOYSA-N
Molecular Formula C18H19N
2,659

4-Cyano-4'-n-pentyloxybiphenyl, 99%

CAS: 52364-71-3 Molecular Formula: C18H19NO Molecular Weight (g/mol): 265.356 MDL Number: MFCD00074879 InChI Key: RDISTOCQRJJICR-UHFFFAOYSA-N Synonym: 4'-pentyloxy-1,1'-biphenyl-4-carbonitrile,4-cyano-4'-pentyloxybiphenyl,4-pentyloxy-4'-cyanobiphenyl,4-amyloxycyanodiphenyl,5ocb,1,1'-biphenyl-4-carbonitrile, 4'-pentyloxy,4'-pentyloxy biphenyl-4-carbonitrile,5cob,m 15 liquid crystal,nzh k 1 PubChem CID: 104171 IUPAC Name: 4-(4-pentoxyphenyl)benzonitrile SMILES: CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N

PubChem CID 104171
CAS 52364-71-3
Molecular Weight (g/mol) 265.356
MDL Number MFCD00074879
SMILES CCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C#N
Synonym 4'-pentyloxy-1,1'-biphenyl-4-carbonitrile,4-cyano-4'-pentyloxybiphenyl,4-pentyloxy-4'-cyanobiphenyl,4-amyloxycyanodiphenyl,5ocb,1,1'-biphenyl-4-carbonitrile, 4'-pentyloxy,4'-pentyloxy biphenyl-4-carbonitrile,5cob,m 15 liquid crystal,nzh k 1
IUPAC Name 4-(4-pentoxyphenyl)benzonitrile
InChI Key RDISTOCQRJJICR-UHFFFAOYSA-N
Molecular Formula C18H19NO
2,660

2-Methoxyphenylboronic acid, 97%

CAS: 5720-06-9 Molecular Formula: C7H9BO3 Molecular Weight (g/mol): 151.96 MDL Number: MFCD00236047 InChI Key: ROEQGIFOWRQYHD-UHFFFAOYSA-N SMILES: COC1=CC=CC=C1B(O)O

CAS 5720-06-9
Molecular Weight (g/mol) 151.96
MDL Number MFCD00236047
SMILES COC1=CC=CC=C1B(O)O
InChI Key ROEQGIFOWRQYHD-UHFFFAOYSA-N
Molecular Formula C7H9BO3
2,661

4-Bromo-2-methylbiphenyl, 98%

CAS: 5002-26-6 Molecular Formula: C13H11Br Molecular Weight (g/mol): 247.135 MDL Number: MFCD03093069 InChI Key: ZBNARPVMXYNXQQ-UHFFFAOYSA-N Synonym: 4-bromo-2-methylbiphenyl,4-bromo-2-methyl-1,1'-biphenyl,acmc-1asrj,2-methyl-4-bromobiphenyl,4-bromo-2-methyl-biphenyl,3-methyl-4-phenylbromobenzene,4-bromanyl-2-methyl-1-phenyl-benzene PubChem CID: 9964845 IUPAC Name: 4-bromo-2-methyl-1-phenylbenzene SMILES: CC1=C(C=CC(=C1)Br)C2=CC=CC=C2

PubChem CID 9964845
CAS 5002-26-6
Molecular Weight (g/mol) 247.135
MDL Number MFCD03093069
SMILES CC1=C(C=CC(=C1)Br)C2=CC=CC=C2
Synonym 4-bromo-2-methylbiphenyl,4-bromo-2-methyl-1,1'-biphenyl,acmc-1asrj,2-methyl-4-bromobiphenyl,4-bromo-2-methyl-biphenyl,3-methyl-4-phenylbromobenzene,4-bromanyl-2-methyl-1-phenyl-benzene
IUPAC Name 4-bromo-2-methyl-1-phenylbenzene
InChI Key ZBNARPVMXYNXQQ-UHFFFAOYSA-N
Molecular Formula C13H11Br
2,662

Racepinephrine Hydrochloride, USP, 97-102%, Spectrum™ Chemical
SDP

CAS: 329-63-5 Molecular Formula: C9H14ClNO3 Molecular Weight (g/mol): 219.67 InChI Key: ATADHKWKHYVBTJ-UHFFFAOYNA-N IUPAC Name: hydrogen 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol chloride SMILES: [H+].[Cl-].CNCC(O)C1=CC=C(O)C(O)=C1

CAS 329-63-5
Molecular Weight (g/mol) 219.67
SMILES [H+].[Cl-].CNCC(O)C1=CC=C(O)C(O)=C1
IUPAC Name hydrogen 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol chloride
InChI Key ATADHKWKHYVBTJ-UHFFFAOYNA-N
Molecular Formula C9H14ClNO3
2,663

Hydroquinone, 99%

CAS: 123-31-9 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.11 MDL Number: MFCD00002339 InChI Key: QIGBRXMKCJKVMJ-UHFFFAOYSA-N Synonym: hydroquinone,1,4-benzenediol,quinol,1,4-dihydroxybenzene,p-benzenediol,4-hydroxyphenol,p-hydroquinone,p-hydroxyphenol,p-dihydroxybenzene,benzoquinol PubChem CID: 785 ChEBI: CHEBI:17594 IUPAC Name: benzene-1,4-diol SMILES: C1=CC(=CC=C1O)O

PubChem CID 785
CAS 123-31-9
Molecular Weight (g/mol) 110.11
ChEBI CHEBI:17594
MDL Number MFCD00002339
SMILES C1=CC(=CC=C1O)O
Synonym hydroquinone,1,4-benzenediol,quinol,1,4-dihydroxybenzene,p-benzenediol,4-hydroxyphenol,p-hydroquinone,p-hydroxyphenol,p-dihydroxybenzene,benzoquinol
IUPAC Name benzene-1,4-diol
InChI Key QIGBRXMKCJKVMJ-UHFFFAOYSA-N
Molecular Formula C6H6O2
2,664

Quinhydrone, MP Biomedicals™

CAS: 106-34-3 Molecular Formula: C12H10O4 Molecular Weight (g/mol): 218.21 MDL Number: MFCD00010310 InChI Key: BDJXVNRFAQSMAA-UHFFFAOYSA-N Synonym: quinhydrone,green hydroquinone,p-benzoquinhydrone,chinhydron,chinhydron czech,unii-p4a66lq3qj,hydroquinone, compd. with p-benzoquinone,p-benzoquinone, compd. with hydroquinone,2,5-cyclohexadiene-1,4-dione, compd. with 1,4-benzenediol 1:1,p-benzoquinone-hydroquinone compound 1:1 PubChem CID: 7801 ChEBI: CHEBI:26491 IUPAC Name: benzene-1,4-diol; cyclohexa-2,5-diene-1,4-dione SMILES: OC1=CC=C(O)C=C1.O=C1C=CC(=O)C=C1

PubChem CID 7801
CAS 106-34-3
Molecular Weight (g/mol) 218.21
ChEBI CHEBI:26491
MDL Number MFCD00010310
SMILES OC1=CC=C(O)C=C1.O=C1C=CC(=O)C=C1
Synonym quinhydrone,green hydroquinone,p-benzoquinhydrone,chinhydron,chinhydron czech,unii-p4a66lq3qj,hydroquinone, compd. with p-benzoquinone,p-benzoquinone, compd. with hydroquinone,2,5-cyclohexadiene-1,4-dione, compd. with 1,4-benzenediol 1:1,p-benzoquinone-hydroquinone compound 1:1
IUPAC Name benzene-1,4-diol; cyclohexa-2,5-diene-1,4-dione
InChI Key BDJXVNRFAQSMAA-UHFFFAOYSA-N
Molecular Formula C12H10O4
2,665

3,4-Dihydroxybenzylamine hydrobromide, 98%

CAS: 16290-26-9 Molecular Formula: C7H10BrNO2 Molecular Weight (g/mol): 220.07 MDL Number: MFCD00012859 InChI Key: BVFZTXFCZAXSHN-UHFFFAOYSA-N Synonym: 3,4-dihydroxybenzylamine hydrobromide,4-aminomethyl benzene-1,2-diol hydrobromide,dhba hydrobromide,acmc-1afa4,1, 4-aminomethyl-, hydrobromide,4-aminomethyl catechol hydrobromide,3,4 dihydroxybenzylamine hydrobromide,3,4-dihy-droxybenzylamine hydrobromide,3,4-dihydroxy benzylamine hydrobromide,4-aminomethyl benzene-1,2-diol, bromide PubChem CID: 13343562 IUPAC Name: 4-(aminomethyl)benzene-1,2-diol;hydrobromide SMILES: [H+].[Br-].NCC1=CC=C(O)C(O)=C1

PubChem CID 13343562
CAS 16290-26-9
Molecular Weight (g/mol) 220.07
MDL Number MFCD00012859
SMILES [H+].[Br-].NCC1=CC=C(O)C(O)=C1
Synonym 3,4-dihydroxybenzylamine hydrobromide,4-aminomethyl benzene-1,2-diol hydrobromide,dhba hydrobromide,acmc-1afa4,1, 4-aminomethyl-, hydrobromide,4-aminomethyl catechol hydrobromide,3,4 dihydroxybenzylamine hydrobromide,3,4-dihy-droxybenzylamine hydrobromide,3,4-dihydroxy benzylamine hydrobromide,4-aminomethyl benzene-1,2-diol, bromide
IUPAC Name 4-(aminomethyl)benzene-1,2-diol;hydrobromide
InChI Key BVFZTXFCZAXSHN-UHFFFAOYSA-N
Molecular Formula C7H10BrNO2
2,666

3,5-Dihydroxybenzoic acid, 97%

CAS: 99-10-5 Molecular Formula: C7H6O4 Molecular Weight (g/mol): 154.12 MDL Number: MFCD00002512 InChI Key: UYEMGAFJOZZIFP-UHFFFAOYSA-N Synonym: alpha-resorcylic acid,5-carboxyresorcinol,benzoic acid, 3,5-dihydroxy,unii-2wc5lmo6l1,3,5-dihydroxy benzoic acid,3,5-dihydroxy-benzoic acid,3,5-dhba,3,5-dihydroxybenzoicacid,a-resorcylic acid,.alpha.-resorcylic acid PubChem CID: 7424 ChEBI: CHEBI:39912 IUPAC Name: 3,5-dihydroxybenzoic acid SMILES: OC(=O)C1=CC(O)=CC(O)=C1

PubChem CID 7424
CAS 99-10-5
Molecular Weight (g/mol) 154.12
ChEBI CHEBI:39912
MDL Number MFCD00002512
SMILES OC(=O)C1=CC(O)=CC(O)=C1
Synonym alpha-resorcylic acid,5-carboxyresorcinol,benzoic acid, 3,5-dihydroxy,unii-2wc5lmo6l1,3,5-dihydroxy benzoic acid,3,5-dihydroxy-benzoic acid,3,5-dhba,3,5-dihydroxybenzoicacid,a-resorcylic acid,.alpha.-resorcylic acid
IUPAC Name 3,5-dihydroxybenzoic acid
InChI Key UYEMGAFJOZZIFP-UHFFFAOYSA-N
Molecular Formula C7H6O4
2,667

3,4-Dihydroxycinnamic acid, 99+%, predominantly trans isomer

CAS: 331-39-5 Molecular Formula: C9H8O4 Molecular Weight (g/mol): 180.16 InChI Key: QAIPRVGONGVQAS-DUXPYHPUSA-N Synonym: caffeic acid,3,4-dihydroxycinnamic acid,3-3,4-dihydroxyphenyl acrylic acid,trans-caffeate,3,4-dihydroxy-trans-cinnamate,2e-3-3,4-dihydroxyphenyl prop-2-enoic acid,3,4-dihydroxybenzeneacrylic acid,e-3-3,4-dihydroxyphenyl acrylic acid,trans-caffeic acid,3-3,4-dihydroxyphenyl propenoic acid PubChem CID: 689043 ChEBI: CHEBI:16433 IUPAC Name: (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid SMILES: C1=CC(=C(C=C1C=CC(=O)O)O)O

PubChem CID 689043
CAS 331-39-5
Molecular Weight (g/mol) 180.16
ChEBI CHEBI:16433
SMILES C1=CC(=C(C=C1C=CC(=O)O)O)O
Synonym caffeic acid,3,4-dihydroxycinnamic acid,3-3,4-dihydroxyphenyl acrylic acid,trans-caffeate,3,4-dihydroxy-trans-cinnamate,2e-3-3,4-dihydroxyphenyl prop-2-enoic acid,3,4-dihydroxybenzeneacrylic acid,e-3-3,4-dihydroxyphenyl acrylic acid,trans-caffeic acid,3-3,4-dihydroxyphenyl propenoic acid
IUPAC Name (E)-3-(3,4-dihydroxyphenyl)prop-2-enoic acid
InChI Key QAIPRVGONGVQAS-DUXPYHPUSA-N
Molecular Formula C9H8O4
2,668

DL-Adrenaline

CAS: 329-65-7 Molecular Formula: C9H13NO3 Molecular Weight (g/mol): 183.207 MDL Number: MFCD00063027 InChI Key: UCTWMZQNUQWSLP-UHFFFAOYSA-N Synonym: dl-adrenaline,racepinephrine,racepinefrine,dl-epinephrine,+--adrenaline,epinephrine racemic,racepinefrina,racepinefrinum,+--epinephrine,4-1-hydroxy-2-methylamino ethyl benzene-1,2-diol PubChem CID: 838 ChEBI: CHEBI:33568 IUPAC Name: 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol SMILES: CNCC(C1=CC(=C(C=C1)O)O)O

PubChem CID 838
CAS 329-65-7
Molecular Weight (g/mol) 183.207
ChEBI CHEBI:33568
MDL Number MFCD00063027
SMILES CNCC(C1=CC(=C(C=C1)O)O)O
Synonym dl-adrenaline,racepinephrine,racepinefrine,dl-epinephrine,+--adrenaline,epinephrine racemic,racepinefrina,racepinefrinum,+--epinephrine,4-1-hydroxy-2-methylamino ethyl benzene-1,2-diol
IUPAC Name 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
InChI Key UCTWMZQNUQWSLP-UHFFFAOYSA-N
Molecular Formula C9H13NO3
2,669

Resorcinol, MP Biomedicals™

CAS: 108-46-3 Molecular Formula: C6H6O2 Molecular Weight (g/mol): 110.112 MDL Number: MFCD00002269 InChI Key: GHMLBKRAJCXXBS-UHFFFAOYSA-N Synonym: resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol 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 resorcinol,1,3-benzenediol,resorcin,1,3-dihydroxybenzene,3-hydroxyphenol,m-hydroquinone,resorcine,m-dihydroxybenzene,m-hydroxyphenol,m-benzenediol
IUPAC Name benzene-1,3-diol
InChI Key GHMLBKRAJCXXBS-UHFFFAOYSA-N
Molecular Formula C6H6O2
2,670

Methyl caffeate

CAS: 3843-74-1 Molecular Formula: C10H10O4 Molecular Weight (g/mol): 194.186 MDL Number: MFCD00210468 InChI Key: OCNYGKNIVPVPPX-HWKANZROSA-N Synonym: methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001 PubChem CID: 689075 ChEBI: CHEBI:6856 IUPAC Name: methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate SMILES: COC(=O)C=CC1=CC(=C(C=C1)O)O

PubChem CID 689075
CAS 3843-74-1
Molecular Weight (g/mol) 194.186
ChEBI CHEBI:6856
MDL Number MFCD00210468
SMILES COC(=O)C=CC1=CC(=C(C=C1)O)O
Synonym methyl caffeate,methyl 3-3,4-dihydroxyphenyl acrylate,caffeic acid methyl ester,e-methyl 3-3,4-dihydroxyphenyl acrylate,methylcaffeate,methyl 3,4-dihydroxycinnamate,caffeic acid, methyl ester,unii-n79173b9hf,methyl 2e-3-3,4-dihydroxyphenyl prop-2-enoate,chembl17001
IUPAC Name methyl (E)-3-(3,4-dihydroxyphenyl)prop-2-enoate
InChI Key OCNYGKNIVPVPPX-HWKANZROSA-N
Molecular Formula C10H10O4