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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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3,016 – 3,030 of 159,106 results
3,016
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Tetrafluoroterephthalonitrile, 98%

CAS: 1835-49-0 Molecular Formula: C8F4N2 Molecular Weight (g/mol): 200.096 MDL Number: MFCD00001776 InChI Key: PCRSJGWFEMHHEW-UHFFFAOYSA-N Synonym: tetrafluoroterephthalonitrile,2,3,5,6-tetrafluoroterephthalonitrile,diamond 2031,2,3,5,6-tetrafluoro-1,4-benzenedicarbonitrile,1,4-benzenedicarbonitrile, 2,3,5,6-tetrafluoro,1,4-dicyanotetrafluorobenzene,terephthalonitrile, tetrafluoro,perfluoroterephthalonitrile,tetrafluoroterephthalodinitrile,tetrafluorobenzene-1,4-dicarbonitrile PubChem CID: 15783 IUPAC Name: 2,3,5,6-tetrafluorobenzene-1,4-dicarbonitrile SMILES: C(#N)C1=C(C(=C(C(=C1F)F)C#N)F)F

PubChem CID 15783
CAS 1835-49-0
Molecular Weight (g/mol) 200.096
MDL Number MFCD00001776
SMILES C(#N)C1=C(C(=C(C(=C1F)F)C#N)F)F
Synonym tetrafluoroterephthalonitrile,2,3,5,6-tetrafluoroterephthalonitrile,diamond 2031,2,3,5,6-tetrafluoro-1,4-benzenedicarbonitrile,1,4-benzenedicarbonitrile, 2,3,5,6-tetrafluoro,1,4-dicyanotetrafluorobenzene,terephthalonitrile, tetrafluoro,perfluoroterephthalonitrile,tetrafluoroterephthalodinitrile,tetrafluorobenzene-1,4-dicarbonitrile
IUPAC Name 2,3,5,6-tetrafluorobenzene-1,4-dicarbonitrile
InChI Key PCRSJGWFEMHHEW-UHFFFAOYSA-N
Molecular Formula C8F4N2
3,017
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4-Bromo-2-(trifluoromethoxy)anisole, 98%

CAS: 853771-88-7 Molecular Formula: C8H6BrF3O2 Molecular Weight (g/mol): 271.03 MDL Number: MFCD09907950 InChI Key: QVGIROOBNUFIKC-UHFFFAOYSA-N Synonym: 4-bromo-2-trifluoromethoxy anisole,4-bromo-1-methoxy-2-trifluoromethoxy benzene,benzene,4-bromo-1-methoxy-2-trifluoromethoxy PubChem CID: 45790939 IUPAC Name: 4-bromo-1-methoxy-2-(trifluoromethoxy)benzene SMILES: COC1=C(OC(F)(F)F)C=C(Br)C=C1

PubChem CID 45790939
CAS 853771-88-7
Molecular Weight (g/mol) 271.03
MDL Number MFCD09907950
SMILES COC1=C(OC(F)(F)F)C=C(Br)C=C1
Synonym 4-bromo-2-trifluoromethoxy anisole,4-bromo-1-methoxy-2-trifluoromethoxy benzene,benzene,4-bromo-1-methoxy-2-trifluoromethoxy
IUPAC Name 4-bromo-1-methoxy-2-(trifluoromethoxy)benzene
InChI Key QVGIROOBNUFIKC-UHFFFAOYSA-N
Molecular Formula C8H6BrF3O2
3,018
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4-Chloroanisole, 99%

CAS: 623-12-1 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.582 MDL Number: MFCD00000616 InChI Key: YRGAYAGBVIXNAQ-UHFFFAOYSA-N Synonym: 4-chloroanisole,benzene, 1-chloro-4-methoxy,p-chloroanisole,p-chlorophenyl methyl ether,anisyl chloride,anisole, p-chloro,p-chloromethoxybenzene,4-chlorophenol methyl ether,1-chloro-4-methoxy-benzene,unii-0f18bly08q PubChem CID: 12167 IUPAC Name: 1-chloro-4-methoxybenzene SMILES: COC1=CC=C(C=C1)Cl

PubChem CID 12167
CAS 623-12-1
Molecular Weight (g/mol) 142.582
MDL Number MFCD00000616
SMILES COC1=CC=C(C=C1)Cl
Synonym 4-chloroanisole,benzene, 1-chloro-4-methoxy,p-chloroanisole,p-chlorophenyl methyl ether,anisyl chloride,anisole, p-chloro,p-chloromethoxybenzene,4-chlorophenol methyl ether,1-chloro-4-methoxy-benzene,unii-0f18bly08q
IUPAC Name 1-chloro-4-methoxybenzene
InChI Key YRGAYAGBVIXNAQ-UHFFFAOYSA-N
Molecular Formula C7H7ClO
3,019
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1,2,3-Trimethoxybenzene, 98%

CAS: 634-36-6 Molecular Formula: C9H12O3 Molecular Weight (g/mol): 168.19 MDL Number: MFCD00008358 InChI Key: CRUILBNAQILVHZ-UHFFFAOYSA-N Synonym: methylsyringol,pyrogallol trimethyl ether,trimethoxybenzene,benzene, 1,2,3-trimethoxy,tri-o-methylpyrogallol,benzene, trimethoxy,unii-mre1o894fg,1,2,3-trimethoxy benzene,mre1o894fg,3,4,5-trimethoxybenzene PubChem CID: 12462 ChEBI: CHEBI:86529 IUPAC Name: 1,2,3-trimethoxybenzene SMILES: COC1=C(C(=CC=C1)OC)OC

PubChem CID 12462
CAS 634-36-6
Molecular Weight (g/mol) 168.19
ChEBI CHEBI:86529
MDL Number MFCD00008358
SMILES COC1=C(C(=CC=C1)OC)OC
Synonym methylsyringol,pyrogallol trimethyl ether,trimethoxybenzene,benzene, 1,2,3-trimethoxy,tri-o-methylpyrogallol,benzene, trimethoxy,unii-mre1o894fg,1,2,3-trimethoxy benzene,mre1o894fg,3,4,5-trimethoxybenzene
IUPAC Name 1,2,3-trimethoxybenzene
InChI Key CRUILBNAQILVHZ-UHFFFAOYSA-N
Molecular Formula C9H12O3
3,020
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3,5-Difluoroanisole, 97%, Thermo Scientific Chemicals

CAS: 93343-10-3 Molecular Formula: C7H6F2O Molecular Weight (g/mol): 144.12 MDL Number: MFCD00042560 InChI Key: OTGQPYSISUUHAF-UHFFFAOYSA-N Synonym: 3,5-difluoroanisole,3,5-difluoro-1-methoxybenzene,benzene, 1,3-difluoro-5-methoxy,1,3-difluoro-5-methoxy-benzene,3,5-difluoro anisole,3,5-difluoroanisol,3.5-difluoroanisole,pubchem1967,3,5-difluoroanisole;,3,5,-difluoroanisole; PubChem CID: 2724518 IUPAC Name: 1,3-difluoro-5-methoxybenzene SMILES: COC1=CC(F)=CC(F)=C1

PubChem CID 2724518
CAS 93343-10-3
Molecular Weight (g/mol) 144.12
MDL Number MFCD00042560
SMILES COC1=CC(F)=CC(F)=C1
Synonym 3,5-difluoroanisole,3,5-difluoro-1-methoxybenzene,benzene, 1,3-difluoro-5-methoxy,1,3-difluoro-5-methoxy-benzene,3,5-difluoro anisole,3,5-difluoroanisol,3.5-difluoroanisole,pubchem1967,3,5-difluoroanisole;,3,5,-difluoroanisole;
IUPAC Name 1,3-difluoro-5-methoxybenzene
InChI Key OTGQPYSISUUHAF-UHFFFAOYSA-N
Molecular Formula C7H6F2O
3,021
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4-Bromo-2-methylanisole, 98+%

CAS: 14804-31-0 Molecular Formula: C8H9BrO Molecular Weight (g/mol): 201.063 MDL Number: MFCD01321139 InChI Key: UDLRGQOHGYWLCS-UHFFFAOYSA-N Synonym: 4-bromo-2-methylanisole,5-bromo-2-methoxytoluene,benzene, 4-bromo-1-methoxy-2-methyl,4-bromo-1-methoxy-2-methyl-benzene,2-methyl-4-bromoanisole,4-bromo2-methylanisole,acmc-1cfej,4-bromo2-methyl-anisole,4-bromo-2-methyl anisole,4-bromo-2-methyl-anisole PubChem CID: 608315 IUPAC Name: 4-bromo-1-methoxy-2-methylbenzene SMILES: CC1=C(C=CC(=C1)Br)OC

PubChem CID 608315
CAS 14804-31-0
Molecular Weight (g/mol) 201.063
MDL Number MFCD01321139
SMILES CC1=C(C=CC(=C1)Br)OC
Synonym 4-bromo-2-methylanisole,5-bromo-2-methoxytoluene,benzene, 4-bromo-1-methoxy-2-methyl,4-bromo-1-methoxy-2-methyl-benzene,2-methyl-4-bromoanisole,4-bromo2-methylanisole,acmc-1cfej,4-bromo2-methyl-anisole,4-bromo-2-methyl anisole,4-bromo-2-methyl-anisole
IUPAC Name 4-bromo-1-methoxy-2-methylbenzene
InChI Key UDLRGQOHGYWLCS-UHFFFAOYSA-N
Molecular Formula C8H9BrO
3,022
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3-(2-Methoxyphenoxy)-1,2-propanediol, 98+%

CAS: 93-14-1 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00016873 InChI Key: HSRJKNPTNIJEKV-UHFFFAOYNA-N Synonym: guaifenesin,guaiphenesin,glyceryl guaiacolate,glycerol guaiacolate,guaiphenesine,guaiacol glyceryl ether,methphenoxydiol,aeronesin,breonesin,bronchol PubChem CID: 3516 IUPAC Name: 3-(2-methoxyphenoxy)propane-1,2-diol SMILES: COC1=CC=CC=C1OCC(O)CO

PubChem CID 3516
CAS 93-14-1
Molecular Weight (g/mol) 198.22
MDL Number MFCD00016873
SMILES COC1=CC=CC=C1OCC(O)CO
Synonym guaifenesin,guaiphenesin,glyceryl guaiacolate,glycerol guaiacolate,guaiphenesine,guaiacol glyceryl ether,methphenoxydiol,aeronesin,breonesin,bronchol
IUPAC Name 3-(2-methoxyphenoxy)propane-1,2-diol
InChI Key HSRJKNPTNIJEKV-UHFFFAOYNA-N
Molecular Formula C10H14O4
3,023
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2-Chloroanisole, 98%

CAS: 766-51-8 Molecular Formula: C7H7ClO Molecular Weight (g/mol): 142.582 MDL Number: MFCD00000557 InChI Key: QGRPVMLBTFGQDQ-UHFFFAOYSA-N Synonym: 2-chloroanisole,o-chloroanisole,benzene, 1-chloro-2-methoxy,anisole, o-chloro,o-chloromethoxybenzene,o-chlorophenyl methyl ether,2-chlorophenol methyl ether,chloroanisole,1-chloro-2-methoxy-benzene,labotest-bb ltbb002921 PubChem CID: 13011 IUPAC Name: 1-chloro-2-methoxybenzene SMILES: COC1=CC=CC=C1Cl

PubChem CID 13011
CAS 766-51-8
Molecular Weight (g/mol) 142.582
MDL Number MFCD00000557
SMILES COC1=CC=CC=C1Cl
Synonym 2-chloroanisole,o-chloroanisole,benzene, 1-chloro-2-methoxy,anisole, o-chloro,o-chloromethoxybenzene,o-chlorophenyl methyl ether,2-chlorophenol methyl ether,chloroanisole,1-chloro-2-methoxy-benzene,labotest-bb ltbb002921
IUPAC Name 1-chloro-2-methoxybenzene
InChI Key QGRPVMLBTFGQDQ-UHFFFAOYSA-N
Molecular Formula C7H7ClO
3,024
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Ethyl 4-methoxyphenylacetate, 97%

CAS: 14062-18-1 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00040760 InChI Key: DOCCDOCIYYDLGJ-UHFFFAOYSA-N Synonym: ethyl 2-4-methoxyphenyl acetate,ethyl 4-methoxyphenylacetate,4-methoxyphenylacetic acid ethyl ester,benzeneacetic acid, 4-methoxy-, ethyl ester,ethyl p-methoxyphenylacetate,ethyl 4-methoxyphenyl acetate,4-methoxy-phenyl-acetic acid ethyl ester,acmc-1bnx2,homoanisic acid ethyl ester PubChem CID: 84174 IUPAC Name: ethyl 2-(4-methoxyphenyl)acetate SMILES: CCOC(=O)CC1=CC=C(C=C1)OC

PubChem CID 84174
CAS 14062-18-1
Molecular Weight (g/mol) 194.23
MDL Number MFCD00040760
SMILES CCOC(=O)CC1=CC=C(C=C1)OC
Synonym ethyl 2-4-methoxyphenyl acetate,ethyl 4-methoxyphenylacetate,4-methoxyphenylacetic acid ethyl ester,benzeneacetic acid, 4-methoxy-, ethyl ester,ethyl p-methoxyphenylacetate,ethyl 4-methoxyphenyl acetate,4-methoxy-phenyl-acetic acid ethyl ester,acmc-1bnx2,homoanisic acid ethyl ester
IUPAC Name ethyl 2-(4-methoxyphenyl)acetate
InChI Key DOCCDOCIYYDLGJ-UHFFFAOYSA-N
Molecular Formula C11H14O3
3,025
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(S)-(-)-1-(4-Methoxyphenyl)ethylamine, ChiPros 99+%, ee 98%

CAS: 41851-59-6 Molecular Formula: C9H13NO Molecular Weight (g/mol): 151.209 MDL Number: MFCD00671660 InChI Key: JTDGKQNNPKXKII-ZETCQYMHSA-N Synonym: s---1-4-methoxyphenyl ethylamine,s-1-4-methoxyphenyl ethanamine,s-1-4-methoxyphenyl ethylamine,s-1-4-methoxy-phenyl-ethylamine,1s-1-4-methoxyphenyl ethanamine,s--1-4-methoxyphenyl ethylamine,s-p-1-4-methoxyphenyl ethylamine,s-1-4-methoxyphenyl ethan-1-amine,1s-1-4-methoxyphenyl ethan-1-amine PubChem CID: 793467 IUPAC Name: (1S)-1-(4-methoxyphenyl)ethanamine SMILES: CC(C1=CC=C(C=C1)OC)N

PubChem CID 793467
CAS 41851-59-6
Molecular Weight (g/mol) 151.209
MDL Number MFCD00671660
SMILES CC(C1=CC=C(C=C1)OC)N
Synonym s---1-4-methoxyphenyl ethylamine,s-1-4-methoxyphenyl ethanamine,s-1-4-methoxyphenyl ethylamine,s-1-4-methoxy-phenyl-ethylamine,1s-1-4-methoxyphenyl ethanamine,s--1-4-methoxyphenyl ethylamine,s-p-1-4-methoxyphenyl ethylamine,s-1-4-methoxyphenyl ethan-1-amine,1s-1-4-methoxyphenyl ethan-1-amine
IUPAC Name (1S)-1-(4-methoxyphenyl)ethanamine
InChI Key JTDGKQNNPKXKII-ZETCQYMHSA-N
Molecular Formula C9H13NO
3,026
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4-Fluoro-2-methoxybenzonitrile, 97%

CAS: 191014-55-8 Molecular Formula: C8H6FNO Molecular Weight (g/mol): 151.14 MDL Number: MFCD04116335 InChI Key: HGBKZVIQHCUHRI-UHFFFAOYSA-N Synonym: benzonitrile, 4-fluoro-2-methoxy,2-methoxy-4-fluorobenzonitrile,4-fluoro-2-methoxy-benzonitrile,benzonitrile, 4-fluoro-2-methoxy-9ci,4-fluoro-2-methoxybenzenecarbonitrile,pubchem4786,acmc-209xzr,ksc494i6t,4fluoro-2-methoxy-benzonitrile,buttpark 80\07-22 PubChem CID: 2783329 IUPAC Name: 4-fluoro-2-methoxybenzonitrile SMILES: COC1=C(C=CC(=C1)F)C#N

PubChem CID 2783329
CAS 191014-55-8
Molecular Weight (g/mol) 151.14
MDL Number MFCD04116335
SMILES COC1=C(C=CC(=C1)F)C#N
Synonym benzonitrile, 4-fluoro-2-methoxy,2-methoxy-4-fluorobenzonitrile,4-fluoro-2-methoxy-benzonitrile,benzonitrile, 4-fluoro-2-methoxy-9ci,4-fluoro-2-methoxybenzenecarbonitrile,pubchem4786,acmc-209xzr,ksc494i6t,4fluoro-2-methoxy-benzonitrile,buttpark 80\07-22
IUPAC Name 4-fluoro-2-methoxybenzonitrile
InChI Key HGBKZVIQHCUHRI-UHFFFAOYSA-N
Molecular Formula C8H6FNO
3,027
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Guaifenesin, USP, 98-102%, Spectrum™ Chemical
SDP

CAS: 93-14-1 Molecular Formula: C10H14O4 Molecular Weight (g/mol): 198.22 MDL Number: MFCD00016873 InChI Key: HSRJKNPTNIJEKV-UHFFFAOYNA-N IUPAC Name: 3-(2-methoxyphenoxy)propane-1,2-diol SMILES: COC1=CC=CC=C1OCC(O)CO

CAS 93-14-1
Molecular Weight (g/mol) 198.22
MDL Number MFCD00016873
SMILES COC1=CC=CC=C1OCC(O)CO
IUPAC Name 3-(2-methoxyphenoxy)propane-1,2-diol
InChI Key HSRJKNPTNIJEKV-UHFFFAOYNA-N
Molecular Formula C10H14O4
3,028
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2-Bromo-4-fluoroanisole, 98%

CAS: 452-08-4 Molecular Formula: C7H6BrFO Molecular Weight (g/mol): 205.03 MDL Number: MFCD00012014 InChI Key: JIQXVIJARQLCOY-UHFFFAOYSA-N Synonym: 2-bromo-4-fluoroanisole,benzene, 2-bromo-4-fluoro-1-methoxy,2-bromo-4-fluoro anisole,1-bromo-3-fluoro-6-methoxybenzene,2-bromo-4-fluoro-methoxybenzene,2-bromo-4-fluoro-1-methoxy-benzene,1-bromo-5-fluoro-2-methoxybenzene,attercop-chm at106665,pubchem1972,2-bromo-4-fluoroanisol PubChem CID: 136292 IUPAC Name: 2-bromo-4-fluoro-1-methoxybenzene SMILES: COC1=CC=C(F)C=C1Br

PubChem CID 136292
CAS 452-08-4
Molecular Weight (g/mol) 205.03
MDL Number MFCD00012014
SMILES COC1=CC=C(F)C=C1Br
Synonym 2-bromo-4-fluoroanisole,benzene, 2-bromo-4-fluoro-1-methoxy,2-bromo-4-fluoro anisole,1-bromo-3-fluoro-6-methoxybenzene,2-bromo-4-fluoro-methoxybenzene,2-bromo-4-fluoro-1-methoxy-benzene,1-bromo-5-fluoro-2-methoxybenzene,attercop-chm at106665,pubchem1972,2-bromo-4-fluoroanisol
IUPAC Name 2-bromo-4-fluoro-1-methoxybenzene
InChI Key JIQXVIJARQLCOY-UHFFFAOYSA-N
Molecular Formula C7H6BrFO
3,029
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4-(4-Hydroxy-3-methoxyphenyl)-2-butanone, 97%

CAS: 122-48-5 Molecular Formula: C11H14O3 Molecular Weight (g/mol): 194.23 MDL Number: MFCD00048232 InChI Key: OJYLAHXKWMRDGS-UHFFFAOYSA-N Synonym: zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl PubChem CID: 31211 ChEBI: CHEBI:68657 IUPAC Name: 4-(4-hydroxy-3-methoxyphenyl)butan-2-one SMILES: CC(=O)CCC1=CC(=C(C=C1)O)OC

PubChem CID 31211
CAS 122-48-5
Molecular Weight (g/mol) 194.23
ChEBI CHEBI:68657
MDL Number MFCD00048232
SMILES CC(=O)CCC1=CC(=C(C=C1)O)OC
Synonym zingerone,vanillylacetone,zingiberone,4-4-hydroxy-3-methoxyphenyl butan-2-one,zingherone,4-4-hydroxy-3-methoxyphenyl-2-butanone,gingerone,vanillyl acetone,0-paradol,2-butanone, 4-4-hydroxy-3-methoxyphenyl
IUPAC Name 4-(4-hydroxy-3-methoxyphenyl)butan-2-one
InChI Key OJYLAHXKWMRDGS-UHFFFAOYSA-N
Molecular Formula C11H14O3
3,030
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4-(Trifluoromethoxy)anisole, 98+%

CAS: 710-18-9 Molecular Formula: C8H7F3O2 Molecular Weight (g/mol): 192.137 MDL Number: MFCD00216942 InChI Key: NOAFZIOGGDPYKK-UHFFFAOYSA-N Synonym: 4-trifluoromethoxy anisole,1-methoxy-4-trifluoromethoxy benzene,p-trifluoromethoxy anisole,4-trifluoromethoxyanisole,benzene, 1-methoxy-4-trifluoromethoxy,4-methoxy trifluoromethoxy benzene,hydroquinone methyl trifluoromethyl ether,trifluoro 4-methoxyphenoxy methane,pubchem3570,acmc-1bcz3 PubChem CID: 2724973 IUPAC Name: 1-methoxy-4-(trifluoromethoxy)benzene SMILES: COC1=CC=C(C=C1)OC(F)(F)F

PubChem CID 2724973
CAS 710-18-9
Molecular Weight (g/mol) 192.137
MDL Number MFCD00216942
SMILES COC1=CC=C(C=C1)OC(F)(F)F
Synonym 4-trifluoromethoxy anisole,1-methoxy-4-trifluoromethoxy benzene,p-trifluoromethoxy anisole,4-trifluoromethoxyanisole,benzene, 1-methoxy-4-trifluoromethoxy,4-methoxy trifluoromethoxy benzene,hydroquinone methyl trifluoromethyl ether,trifluoro 4-methoxyphenoxy methane,pubchem3570,acmc-1bcz3
IUPAC Name 1-methoxy-4-(trifluoromethoxy)benzene
InChI Key NOAFZIOGGDPYKK-UHFFFAOYSA-N
Molecular Formula C8H7F3O2