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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 (129,837)
Phenols (24,890)
Naphthalenes (6,294)
Phenol esters (4,685)
Unsubstituted Phenols (1,453)
Fluorenes (1,282)
Thiophenols (748)
Anthracenes (509)
Indanes (489)
Phenanthrenes and derivatives (364)
Tetralins (340)
Pyrenes (281)
Triphenyl compounds (280)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (20)
Acenaphthylenes (17)
Pentacenequinones (16)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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2,311 – 2,325 of 158,358 results
2,311
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4-(Trifluoromethyl)phenyl isothiocyanate, 98+%

CAS: 1645-65-4 Molecular Formula: C8H4F3NS Molecular Weight (g/mol): 203.182 MDL Number: MFCD00039645 InChI Key: DQEVDFQAYLIBRD-UHFFFAOYSA-N Synonym: 4-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-4-trifluoromethyl benzene,4-trifluoromethyl phenylisothiocyanate,4-trifluoromethylphenylisothiocyanate,p-trifluoromethylphenyl isothiocyanate,benzene, 1-isothiocyanato-4-trifluoromethyl,alpha,alpha,alpha-trifluoro-p-tolyl isothiocyanate,isothiocyanic acid 4-trifluoromethyl phenyl ester,4-trifluoromethylphenyl isothiocyanate,1-isothiocyanato-4-trifluoromethyl-benzene PubChem CID: 137134 IUPAC Name: 1-isothiocyanato-4-(trifluoromethyl)benzene SMILES: C1=CC(=CC=C1C(F)(F)F)N=C=S

PubChem CID 137134
CAS 1645-65-4
Molecular Weight (g/mol) 203.182
MDL Number MFCD00039645
SMILES C1=CC(=CC=C1C(F)(F)F)N=C=S
Synonym 4-trifluoromethyl phenyl isothiocyanate,1-isothiocyanato-4-trifluoromethyl benzene,4-trifluoromethyl phenylisothiocyanate,4-trifluoromethylphenylisothiocyanate,p-trifluoromethylphenyl isothiocyanate,benzene, 1-isothiocyanato-4-trifluoromethyl,alpha,alpha,alpha-trifluoro-p-tolyl isothiocyanate,isothiocyanic acid 4-trifluoromethyl phenyl ester,4-trifluoromethylphenyl isothiocyanate,1-isothiocyanato-4-trifluoromethyl-benzene
IUPAC Name 1-isothiocyanato-4-(trifluoromethyl)benzene
InChI Key DQEVDFQAYLIBRD-UHFFFAOYSA-N
Molecular Formula C8H4F3NS
2,312
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3,4-Dimethoxytoluene, 98%

CAS: 494-99-5 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.193 MDL Number: MFCD00016651 InChI Key: GYPMBQZAVBFUIZ-UHFFFAOYSA-N Synonym: 3,4-dimethoxytoluene,homoveratrole,4-methylveratrole,benzene, 1,2-dimethoxy-4-methyl,4-methylveratrol,4-methyl-1,2-dimethoxybenzene,1,2-dimethoxy-4-methyl-benzene,unii-349x0g2ssf,homoveratrol PubChem CID: 68126 IUPAC Name: 1,2-dimethoxy-4-methylbenzene SMILES: CC1=CC(=C(C=C1)OC)OC

PubChem CID 68126
CAS 494-99-5
Molecular Weight (g/mol) 152.193
MDL Number MFCD00016651
SMILES CC1=CC(=C(C=C1)OC)OC
Synonym 3,4-dimethoxytoluene,homoveratrole,4-methylveratrole,benzene, 1,2-dimethoxy-4-methyl,4-methylveratrol,4-methyl-1,2-dimethoxybenzene,1,2-dimethoxy-4-methyl-benzene,unii-349x0g2ssf,homoveratrol
IUPAC Name 1,2-dimethoxy-4-methylbenzene
InChI Key GYPMBQZAVBFUIZ-UHFFFAOYSA-N
Molecular Formula C9H12O2
2,313
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Methyl pentafluorophenyl carbonate, 97%, Thermo Scientific Chemicals

CAS: 36919-03-6 Molecular Formula: C8H3F5O3 Molecular Weight (g/mol): 242.10 MDL Number: MFCD01075723 InChI Key: HGYOVHMDBHQLOE-UHFFFAOYSA-N Synonym: methyl pentafluorophenyl carbonate,carbonic acid, methyl pentafluorophenyl ester,acmc-20akf4,pentafluorophenoxy methoxy ketone,methyl perfluorophenyl carbonate,carbonic acid methyl pentafluorophenyl ester PubChem CID: 14189360 SMILES: COC(=O)OC1=C(F)C(F)=C(F)C(F)=C1F

PubChem CID 14189360
CAS 36919-03-6
Molecular Weight (g/mol) 242.10
MDL Number MFCD01075723
SMILES COC(=O)OC1=C(F)C(F)=C(F)C(F)=C1F
Synonym methyl pentafluorophenyl carbonate,carbonic acid, methyl pentafluorophenyl ester,acmc-20akf4,pentafluorophenoxy methoxy ketone,methyl perfluorophenyl carbonate,carbonic acid methyl pentafluorophenyl ester
InChI Key HGYOVHMDBHQLOE-UHFFFAOYSA-N
Molecular Formula C8H3F5O3
2,314

4-Amino-3-(trifluoromethoxy)benzonitrile, ≥97%, Thermo Scientific™

CAS: 175278-23-6 Molecular Formula: C8H5F3N2O Molecular Weight (g/mol): 202.14 MDL Number: MFCD00204177 InChI Key: QNJPSMLILRHZOW-UHFFFAOYSA-N Synonym: 4-amino-3-trifluoromethoxy benzonitrile,benzonitrile, 4-amino-3-trifluoromethoxy,3-trifluoromethoxy-4-aminobenzonitrile,4-amino-3-trifluoromethoxy benzenecarbonitrile,pubchem4688,ksc535q4r,buttpark 81\01-97,4-cyano-2-trifluoromethoxy-aniline,4-cyano-2-trifluoromethoxy aniline,4-amino-3-trifluoromethoxy-benzonitrile PubChem CID: 2735952 IUPAC Name: 4-amino-3-(trifluoromethoxy)benzonitrile SMILES: NC1=C(OC(F)(F)F)C=C(C=C1)C#N

PubChem CID 2735952
CAS 175278-23-6
Molecular Weight (g/mol) 202.14
MDL Number MFCD00204177
SMILES NC1=C(OC(F)(F)F)C=C(C=C1)C#N
Synonym 4-amino-3-trifluoromethoxy benzonitrile,benzonitrile, 4-amino-3-trifluoromethoxy,3-trifluoromethoxy-4-aminobenzonitrile,4-amino-3-trifluoromethoxy benzenecarbonitrile,pubchem4688,ksc535q4r,buttpark 81\01-97,4-cyano-2-trifluoromethoxy-aniline,4-cyano-2-trifluoromethoxy aniline,4-amino-3-trifluoromethoxy-benzonitrile
IUPAC Name 4-amino-3-(trifluoromethoxy)benzonitrile
InChI Key QNJPSMLILRHZOW-UHFFFAOYSA-N
Molecular Formula C8H5F3N2O
2,315
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3-Phenoxy-1-propanol, 97%

CAS: 6180-61-6 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00039549 InChI Key: AWVDYRFLCAZENH-UHFFFAOYSA-N Synonym: 3-phenoxy-1-propanol,1-propanol, 3-phenoxy,3-phenoxy 1-propanol,unii-515pbp1u72,propoxylated phenol,ph 4p,polypropylene glycol phenyl ether,3-phenoxypropanol,3-phenyloxypropanol,polypropylene glycol monophenyl ether PubChem CID: 80319 IUPAC Name: 3-phenoxypropan-1-ol SMILES: OCCCOC1=CC=CC=C1

PubChem CID 80319
CAS 6180-61-6
Molecular Weight (g/mol) 152.19
MDL Number MFCD00039549
SMILES OCCCOC1=CC=CC=C1
Synonym 3-phenoxy-1-propanol,1-propanol, 3-phenoxy,3-phenoxy 1-propanol,unii-515pbp1u72,propoxylated phenol,ph 4p,polypropylene glycol phenyl ether,3-phenoxypropanol,3-phenyloxypropanol,polypropylene glycol monophenyl ether
IUPAC Name 3-phenoxypropan-1-ol
InChI Key AWVDYRFLCAZENH-UHFFFAOYSA-N
Molecular Formula C9H12O2
2,316
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4-Ethoxybenzonitrile, 98%

CAS: 25117-74-2 Molecular Formula: C9H9NO Molecular Weight (g/mol): 147.177 MDL Number: MFCD00001819 InChI Key: PJRLUGQMEZZDIY-UHFFFAOYSA-N Synonym: benzonitrile, 4-ethoxy,p-ethoxycyanobenzene,p-ethoxybenzonitrile,4-ethoxybenzoic acid nitrile,benzonitrile, p-ethoxy,4-ethoxybenzenecarbonitrile,4-ethoxy-benzonitrile,4-ethyloxybenzonitrile,acmc-1cis8 PubChem CID: 141176 IUPAC Name: 4-ethoxybenzonitrile SMILES: CCOC1=CC=C(C=C1)C#N

PubChem CID 141176
CAS 25117-74-2
Molecular Weight (g/mol) 147.177
MDL Number MFCD00001819
SMILES CCOC1=CC=C(C=C1)C#N
Synonym benzonitrile, 4-ethoxy,p-ethoxycyanobenzene,p-ethoxybenzonitrile,4-ethoxybenzoic acid nitrile,benzonitrile, p-ethoxy,4-ethoxybenzenecarbonitrile,4-ethoxy-benzonitrile,4-ethyloxybenzonitrile,acmc-1cis8
IUPAC Name 4-ethoxybenzonitrile
InChI Key PJRLUGQMEZZDIY-UHFFFAOYSA-N
Molecular Formula C9H9NO
2,317
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1,3-Dimethoxybenzene, 99%

CAS: 151-10-0 Molecular Formula: C8H10O2 Molecular Weight (g/mol): 138.17 MDL Number: MFCD00008384 InChI Key: DPZNOMCNRMUKPS-UHFFFAOYSA-N Synonym: m-dimethoxybenzene,resorcinol dimethyl ether,benzene, 1,3-dimethoxy,3-methoxyanisole,benzene, m-dimethoxy,dimethyl resorcinol,m-methoxyanisole,dimethylresorcinol,methoxyanisole, m,dimethylether resorcinolu PubChem CID: 9025 IUPAC Name: 1,3-dimethoxybenzene SMILES: COC1=CC(OC)=CC=C1

PubChem CID 9025
CAS 151-10-0
Molecular Weight (g/mol) 138.17
MDL Number MFCD00008384
SMILES COC1=CC(OC)=CC=C1
Synonym m-dimethoxybenzene,resorcinol dimethyl ether,benzene, 1,3-dimethoxy,3-methoxyanisole,benzene, m-dimethoxy,dimethyl resorcinol,m-methoxyanisole,dimethylresorcinol,methoxyanisole, m,dimethylether resorcinolu
IUPAC Name 1,3-dimethoxybenzene
InChI Key DPZNOMCNRMUKPS-UHFFFAOYSA-N
Molecular Formula C8H10O2
2,318
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4-Ethoxyphenylacetic acid, 98%

CAS: 4919-33-9 Molecular Formula: C10H12O3 Molecular Weight (g/mol): 180.203 MDL Number: MFCD00004346 InChI Key: ZVVWZNFSMIFGEP-UHFFFAOYSA-N Synonym: 4-ethoxyphenylacetic acid,2-4-ethoxyphenyl acetic acid,4-ethoxyphenyl acetic acid,benzeneacetic acid, 4-ethoxy,p-ethoxyphenylacetic acid,para-ethoxyphenylacetic acid,acmc-20amjb,4-ethoxyphenylaceticacid,enamine_004828,p-ethoxyphenyl acetic acid PubChem CID: 78631 IUPAC Name: 2-(4-ethoxyphenyl)acetic acid SMILES: CCOC1=CC=C(C=C1)CC(=O)O

PubChem CID 78631
CAS 4919-33-9
Molecular Weight (g/mol) 180.203
MDL Number MFCD00004346
SMILES CCOC1=CC=C(C=C1)CC(=O)O
Synonym 4-ethoxyphenylacetic acid,2-4-ethoxyphenyl acetic acid,4-ethoxyphenyl acetic acid,benzeneacetic acid, 4-ethoxy,p-ethoxyphenylacetic acid,para-ethoxyphenylacetic acid,acmc-20amjb,4-ethoxyphenylaceticacid,enamine_004828,p-ethoxyphenyl acetic acid
IUPAC Name 2-(4-ethoxyphenyl)acetic acid
InChI Key ZVVWZNFSMIFGEP-UHFFFAOYSA-N
Molecular Formula C10H12O3
2,319
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3,5-Dimethoxytoluene, 98%

CAS: 4179-19-5 Molecular Formula: C9H12O2 Molecular Weight (g/mol): 152.19 MDL Number: MFCD00015435 InChI Key: RIZBLVRXRWHLFA-UHFFFAOYSA-N Synonym: 3,5-dimethoxytoluene,orcinol dimethyl ether,benzene, 1,3-dimethoxy-5-methyl,5-methylresorcinol dimethyl ether,3,5-dimethoxy toluene,toluene, 3,5-dimethoxy,1,3-dimethoxy-5-methyl-benzene,pubchem17775,acmc-1ak5i PubChem CID: 77844 IUPAC Name: 1,3-dimethoxy-5-methylbenzene SMILES: COC1=CC(OC)=CC(C)=C1

PubChem CID 77844
CAS 4179-19-5
Molecular Weight (g/mol) 152.19
MDL Number MFCD00015435
SMILES COC1=CC(OC)=CC(C)=C1
Synonym 3,5-dimethoxytoluene,orcinol dimethyl ether,benzene, 1,3-dimethoxy-5-methyl,5-methylresorcinol dimethyl ether,3,5-dimethoxy toluene,toluene, 3,5-dimethoxy,1,3-dimethoxy-5-methyl-benzene,pubchem17775,acmc-1ak5i
IUPAC Name 1,3-dimethoxy-5-methylbenzene
InChI Key RIZBLVRXRWHLFA-UHFFFAOYSA-N
Molecular Formula C9H12O2
2,320

3-[(6-Methylpyrazin-2-yl)oxy]aniline, 97%, Thermo Scientific™

CAS: 915707-61-8 Molecular Formula: C11H11N3O Molecular Weight (g/mol): 201.229 MDL Number: MFCD09702406 InChI Key: ZFDWDKWQAXTCSU-UHFFFAOYSA-N PubChem CID: 24229682 IUPAC Name: 3-(6-methylpyrazin-2-yl)oxyaniline SMILES: CC1=CN=CC(=N1)OC2=CC=CC(=C2)N

PubChem CID 24229682
CAS 915707-61-8
Molecular Weight (g/mol) 201.229
MDL Number MFCD09702406
SMILES CC1=CN=CC(=N1)OC2=CC=CC(=C2)N
IUPAC Name 3-(6-methylpyrazin-2-yl)oxyaniline
InChI Key ZFDWDKWQAXTCSU-UHFFFAOYSA-N
Molecular Formula C11H11N3O
2,321
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4-(Difluoromethoxy)aniline, 97%

CAS: 22236-10-8 Molecular Formula: C7H7F2NO Molecular Weight (g/mol): 159.136 MDL Number: MFCD00085005 InChI Key: NDEZTSHWEPQVBX-UHFFFAOYSA-N Synonym: 4-difluoromethoxy aniline,4-difluoromethoxy-phenylamine,p-difluoromethoxyaniline,4-amino-alpha,alpha-difluoroanisole,4-difluoromethoxy benzenamine,benzenamine, 4-difluoromethoxy,4-difluoromethoxy phenylamine,4-difluormethoxy anilin,pubchem8467 PubChem CID: 737363 IUPAC Name: 4-(difluoromethoxy)aniline SMILES: C1=CC(=CC=C1N)OC(F)F

PubChem CID 737363
CAS 22236-10-8
Molecular Weight (g/mol) 159.136
MDL Number MFCD00085005
SMILES C1=CC(=CC=C1N)OC(F)F
Synonym 4-difluoromethoxy aniline,4-difluoromethoxy-phenylamine,p-difluoromethoxyaniline,4-amino-alpha,alpha-difluoroanisole,4-difluoromethoxy benzenamine,benzenamine, 4-difluoromethoxy,4-difluoromethoxy phenylamine,4-difluormethoxy anilin,pubchem8467
IUPAC Name 4-(difluoromethoxy)aniline
InChI Key NDEZTSHWEPQVBX-UHFFFAOYSA-N
Molecular Formula C7H7F2NO
2,322
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Phenyl methanesulfonate, 98%

CAS: 16156-59-5 Molecular Formula: C7H8O3S Molecular Weight (g/mol): 172.20 MDL Number: MFCD00095143 InChI Key: WXVUCMFEGJUVTN-UHFFFAOYSA-N Synonym: phenyl methylsulfonate,phenyl methyl sulfonate,acmc-1bs7l,phenylmethanesulfonate 4,phenyl methanesulfonate,methanesulfonic acid,phenyl ester,methanesulfonic acid phenyl ester,methanesulfonic acid, phenyl ester PubChem CID: 316170 IUPAC Name: phenyl methanesulfonate SMILES: CS(=O)(=O)OC1=CC=CC=C1

PubChem CID 316170
CAS 16156-59-5
Molecular Weight (g/mol) 172.20
MDL Number MFCD00095143
SMILES CS(=O)(=O)OC1=CC=CC=C1
Synonym phenyl methylsulfonate,phenyl methyl sulfonate,acmc-1bs7l,phenylmethanesulfonate 4,phenyl methanesulfonate,methanesulfonic acid,phenyl ester,methanesulfonic acid phenyl ester,methanesulfonic acid, phenyl ester
IUPAC Name phenyl methanesulfonate
InChI Key WXVUCMFEGJUVTN-UHFFFAOYSA-N
Molecular Formula C7H8O3S
2,323
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p-Tolyl chloroformate, 97%

CAS: 937-62-2 Molecular Formula: C8H7ClO2 Molecular Weight (g/mol): 170.6 MDL Number: MFCD00013255 InChI Key: XOFZPIYYMJUNRG-UHFFFAOYSA-N Synonym: p-tolyl chloroformate,4-methylphenyl chloroformate,p-tolylchloroformate,tolyl chloroformate,4-tolylchloroformate,p-tolyl-chloroformate,4-tolyl chloroformate,p-tolyl carbonochloridate,p-methylphenyl chloroformate PubChem CID: 70304 IUPAC Name: (4-methylphenyl) carbonochloridate SMILES: CC1=CC=C(C=C1)OC(=O)Cl

PubChem CID 70304
CAS 937-62-2
Molecular Weight (g/mol) 170.6
MDL Number MFCD00013255
SMILES CC1=CC=C(C=C1)OC(=O)Cl
Synonym p-tolyl chloroformate,4-methylphenyl chloroformate,p-tolylchloroformate,tolyl chloroformate,4-tolylchloroformate,p-tolyl-chloroformate,4-tolyl chloroformate,p-tolyl carbonochloridate,p-methylphenyl chloroformate
IUPAC Name (4-methylphenyl) carbonochloridate
InChI Key XOFZPIYYMJUNRG-UHFFFAOYSA-N
Molecular Formula C8H7ClO2
2,324
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Ethyl 3-phenoxypropionate, 98%

CAS: 22409-91-2 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00026919 InChI Key: TXKJOPXGYSFUNC-UHFFFAOYSA-N PubChem CID: 347973 IUPAC Name: ethyl 3-phenoxypropanoate SMILES: CCOC(=O)CCOC1=CC=CC=C1

PubChem CID 347973
CAS 22409-91-2
Molecular Weight (g/mol) 194.23
MDL Number MFCD00026919
SMILES CCOC(=O)CCOC1=CC=CC=C1
IUPAC Name ethyl 3-phenoxypropanoate
InChI Key TXKJOPXGYSFUNC-UHFFFAOYSA-N
Molecular Formula C11H14O3
2,325
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4-Ethoxybenzoic acid, 98+%

CAS: 619-86-3 Molecular Formula: C9H10O3 Molecular Weight (g/mol): 166.176 MDL Number: MFCD00002545 InChI Key: SHSGDXCJYVZFTP-UHFFFAOYSA-N Synonym: p-ethoxybenzoic acid,benzoic acid, 4-ethoxy,benzoic acid, p-ethoxy,4-ethoxy-benzoic acid,unii-tzr23xeq7w,tzr23xeq7w,4-ethoxybenzoicacid,4ethoxybenzoic acid,pubchem2686,para-ethoxybenzoic acid PubChem CID: 12093 IUPAC Name: 4-ethoxybenzoic acid SMILES: CCOC1=CC=C(C=C1)C(=O)O

PubChem CID 12093
CAS 619-86-3
Molecular Weight (g/mol) 166.176
MDL Number MFCD00002545
SMILES CCOC1=CC=C(C=C1)C(=O)O
Synonym p-ethoxybenzoic acid,benzoic acid, 4-ethoxy,benzoic acid, p-ethoxy,4-ethoxy-benzoic acid,unii-tzr23xeq7w,tzr23xeq7w,4-ethoxybenzoicacid,4ethoxybenzoic acid,pubchem2686,para-ethoxybenzoic acid
IUPAC Name 4-ethoxybenzoic acid
InChI Key SHSGDXCJYVZFTP-UHFFFAOYSA-N
Molecular Formula C9H10O3