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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 (128,737)
Phenols (24,765)
Naphthalenes (6,294)
Phenol esters (4,693)
Unsubstituted Phenols (1,439)
Fluorenes (1,296)
Thiophenols (747)
Anthracenes (509)
Indanes (479)
Phenanthrenes and derivatives (357)
Tetralins (339)
Pyrenes (298)
Triphenyl compounds (279)
Dibenzocycloheptenes (60)
Naphthacenes (35)
Ellagic acids and derivatives (33)
Pentacenes (22)
Acenaphthylenes (17)
Pentacenequinones (17)
Perylenequinones (8)
1-hydroxylamino 2-unsubstituted benzenoids (5)

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2,251 – 2,265 of 157,166 results
2,251
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1,3-Di-tert-butylbenzene, 99%

CAS: 1014-60-4 Molecular Formula: C14H22 Molecular Weight (g/mol): 190.33 MDL Number: MFCD00008830 InChI Key: ILNDSSCEZZFNGE-UHFFFAOYSA-N Synonym: 1,3-di-tert-butylbenzene,benzene, 1,3-bis 1,1-dimethylethyl,benzene, m-di-tert-butyl,m-di-tert-butylbenzene,1,3-di-t-butylbenzene,1,3-ditert-butyl-benzene,1,3-ditertiarybutylbenzene,1,3-di-tert-butyl-benzene,acmc-1bo58,1,3-bis tert-butyl benzene PubChem CID: 136810 IUPAC Name: 1,3-ditert-butylbenzene SMILES: CC(C)(C)C1=CC(=CC=C1)C(C)(C)C

PubChem CID 136810
CAS 1014-60-4
Molecular Weight (g/mol) 190.33
MDL Number MFCD00008830
SMILES CC(C)(C)C1=CC(=CC=C1)C(C)(C)C
Synonym 1,3-di-tert-butylbenzene,benzene, 1,3-bis 1,1-dimethylethyl,benzene, m-di-tert-butyl,m-di-tert-butylbenzene,1,3-di-t-butylbenzene,1,3-ditert-butyl-benzene,1,3-ditertiarybutylbenzene,1,3-di-tert-butyl-benzene,acmc-1bo58,1,3-bis tert-butyl benzene
IUPAC Name 1,3-ditert-butylbenzene
InChI Key ILNDSSCEZZFNGE-UHFFFAOYSA-N
Molecular Formula C14H22
2,252
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1-tert-Butyl-3-ethylbenzene, 98%

CAS: 14411-56-4 Molecular Formula: C12H18 Molecular Weight (g/mol): 162.276 MDL Number: MFCD00060845 InChI Key: MUJPTTGNHRHIPH-UHFFFAOYSA-N PubChem CID: 139753 IUPAC Name: 1-tert-butyl-3-ethylbenzene SMILES: CCC1=CC(=CC=C1)C(C)(C)C

PubChem CID 139753
CAS 14411-56-4
Molecular Weight (g/mol) 162.276
MDL Number MFCD00060845
SMILES CCC1=CC(=CC=C1)C(C)(C)C
IUPAC Name 1-tert-butyl-3-ethylbenzene
InChI Key MUJPTTGNHRHIPH-UHFFFAOYSA-N
Molecular Formula C12H18
2,253
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2-Chloro-6-fluorobenzamide, 98%

CAS: 66073-54-9 Molecular Formula: C7H5ClFNO Molecular Weight (g/mol): 173.571 MDL Number: MFCD00055436 InChI Key: KLOZZZNFJYMTNE-UHFFFAOYSA-N PubChem CID: 98564 IUPAC Name: 2-chloro-6-fluorobenzamide SMILES: C1=CC(=C(C(=C1)Cl)C(=O)N)F

PubChem CID 98564
CAS 66073-54-9
Molecular Weight (g/mol) 173.571
MDL Number MFCD00055436
SMILES C1=CC(=C(C(=C1)Cl)C(=O)N)F
IUPAC Name 2-chloro-6-fluorobenzamide
InChI Key KLOZZZNFJYMTNE-UHFFFAOYSA-N
Molecular Formula C7H5ClFNO
2,254
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N-Methylanthranilic acid, 90+%

CAS: 119-68-6 Molecular Formula: C8H9NO2 Molecular Weight (g/mol): 151.165 MDL Number: MFCD00002424 InChI Key: WVMBPWMAQDVZCM-UHFFFAOYSA-N Synonym: n-methylanthranilic acid,2-methylamino benzoic acid,n-methyl-2-aminobenzoic acid,n-methyl-o-aminobenzoic acid,benzoic acid, 2-methylamino,o-methylamino benzoic acid,anthranilic acid, n-methyl,2-methylamino-benzoic acid,kyselina n-methylanthranilova,unii-vpb2514iuj PubChem CID: 67069 ChEBI: CHEBI:16394 IUPAC Name: 2-(methylamino)benzoic acid SMILES: CNC1=CC=CC=C1C(=O)O

PubChem CID 67069
CAS 119-68-6
Molecular Weight (g/mol) 151.165
ChEBI CHEBI:16394
MDL Number MFCD00002424
SMILES CNC1=CC=CC=C1C(=O)O
Synonym n-methylanthranilic acid,2-methylamino benzoic acid,n-methyl-2-aminobenzoic acid,n-methyl-o-aminobenzoic acid,benzoic acid, 2-methylamino,o-methylamino benzoic acid,anthranilic acid, n-methyl,2-methylamino-benzoic acid,kyselina n-methylanthranilova,unii-vpb2514iuj
IUPAC Name 2-(methylamino)benzoic acid
InChI Key WVMBPWMAQDVZCM-UHFFFAOYSA-N
Molecular Formula C8H9NO2
2,255
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2,4,6-Trifluorobenzoic acid, 98%

CAS: 28314-80-9 Molecular Formula: C7H3F3O2 Molecular Weight (g/mol): 176.094 MDL Number: MFCD00042398 InChI Key: SJZATRRXUILGHH-UHFFFAOYSA-N Synonym: benzoic acid, 2,4,6-trifluoro,2,4,6-trifluorobenzoicacid,the derivatives,2,4,6-trifluorobenzioc acid,pubchem1347,acmc-209h1r,ksc204g9t,2,4,6-trifluoro-benzoic acid,rarechem al bo 0448,benzoicacid, 2,4,6-trifluoro PubChem CID: 520373 IUPAC Name: 2,4,6-trifluorobenzoic acid SMILES: C1=C(C=C(C(=C1F)C(=O)O)F)F

PubChem CID 520373
CAS 28314-80-9
Molecular Weight (g/mol) 176.094
MDL Number MFCD00042398
SMILES C1=C(C=C(C(=C1F)C(=O)O)F)F
Synonym benzoic acid, 2,4,6-trifluoro,2,4,6-trifluorobenzoicacid,the derivatives,2,4,6-trifluorobenzioc acid,pubchem1347,acmc-209h1r,ksc204g9t,2,4,6-trifluoro-benzoic acid,rarechem al bo 0448,benzoicacid, 2,4,6-trifluoro
IUPAC Name 2,4,6-trifluorobenzoic acid
InChI Key SJZATRRXUILGHH-UHFFFAOYSA-N
Molecular Formula C7H3F3O2
2,256
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3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxylic acid, 99%

CAS: 3919-74-2 Molecular Formula: C11H7ClFNO3 Molecular Weight (g/mol): 255.63 MDL Number: MFCD00055659 InChI Key: REIPZLFZMOQHJT-UHFFFAOYSA-N Synonym: 3-2-chloro-6-fluorophenyl-5-methylisoxazole-4-carboxylic acid,3-2-chloro-6-fluorophenyl-5-methyl-1,2-oxazole-4-carboxylic acid,fcimic acid,4-isoxazolecarboxylic acid, 3-2-chloro-6-fluorophenyl-5-methyl,3-2-chloro-6-fluorophenyl-5-methyl-4-isoxazolecarboxylic acid,3-2-dihloro-6-fluorophenyl-5-methylisoxazole-4-carboxylic acid,3-2-chloro-6-fluorophenyl-5-methyl-4-isoxazolecarboxic acid,pubchem8772,acmc-1ckjh,3-2-chloro-6-fluorophenyl 5-methylisoxazole-4-carboxylic acid PubChem CID: 77520 IUPAC Name: 3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid SMILES: CC1=C(C(O)=O)C(=NO1)C1=C(F)C=CC=C1Cl

PubChem CID 77520
CAS 3919-74-2
Molecular Weight (g/mol) 255.63
MDL Number MFCD00055659
SMILES CC1=C(C(O)=O)C(=NO1)C1=C(F)C=CC=C1Cl
Synonym 3-2-chloro-6-fluorophenyl-5-methylisoxazole-4-carboxylic acid,3-2-chloro-6-fluorophenyl-5-methyl-1,2-oxazole-4-carboxylic acid,fcimic acid,4-isoxazolecarboxylic acid, 3-2-chloro-6-fluorophenyl-5-methyl,3-2-chloro-6-fluorophenyl-5-methyl-4-isoxazolecarboxylic acid,3-2-dihloro-6-fluorophenyl-5-methylisoxazole-4-carboxylic acid,3-2-chloro-6-fluorophenyl-5-methyl-4-isoxazolecarboxic acid,pubchem8772,acmc-1ckjh,3-2-chloro-6-fluorophenyl 5-methylisoxazole-4-carboxylic acid
IUPAC Name 3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxylic acid
InChI Key REIPZLFZMOQHJT-UHFFFAOYSA-N
Molecular Formula C11H7ClFNO3
2,257
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2-(Methylthio)phenol, 97+%

CAS: 1073-29-6 Molecular Formula: C7H8OS Molecular Weight (g/mol): 140.20 MDL Number: MFCD00002211 InChI Key: SOOARYARZPXNAL-UHFFFAOYSA-N Synonym: 2-methylthio phenol,2-hydroxythioanisole,2-methylsulfanyl phenol,2-hydroxy thioanisole,phenol, 2-methylthio,o-hydroxythioanisole,o-methylthio phenol,phenol, o-methylthio,2-methylmercaptophenol,2-methylmercapto phenol PubChem CID: 61261 IUPAC Name: 2-methylsulfanylphenol SMILES: CSC1=CC=CC=C1O

PubChem CID 61261
CAS 1073-29-6
Molecular Weight (g/mol) 140.20
MDL Number MFCD00002211
SMILES CSC1=CC=CC=C1O
Synonym 2-methylthio phenol,2-hydroxythioanisole,2-methylsulfanyl phenol,2-hydroxy thioanisole,phenol, 2-methylthio,o-hydroxythioanisole,o-methylthio phenol,phenol, o-methylthio,2-methylmercaptophenol,2-methylmercapto phenol
IUPAC Name 2-methylsulfanylphenol
InChI Key SOOARYARZPXNAL-UHFFFAOYSA-N
Molecular Formula C7H8OS
2,258
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2-Ethylthiophenol, 95%

CAS: 4500-58-7 Molecular Formula: C8H10S Molecular Weight (g/mol): 138.228 MDL Number: MFCD00010022 InChI Key: ABROBCBIIWHVNS-UHFFFAOYSA-N Synonym: 2-ethylthiophenol,benzenethiol, 2-ethyl,unii-62gbu45i5p,2-ethyl thiophenol,o-ethylbenzenethiol,fema no. 3345,ethylbenzenethiol, o,2-ethylphenylmercaptan,benzenethiol, o-ethyl,o-ethylthiophenol PubChem CID: 3734338 IUPAC Name: 2-ethylbenzenethiol SMILES: CCC1=CC=CC=C1S

PubChem CID 3734338
CAS 4500-58-7
Molecular Weight (g/mol) 138.228
MDL Number MFCD00010022
SMILES CCC1=CC=CC=C1S
Synonym 2-ethylthiophenol,benzenethiol, 2-ethyl,unii-62gbu45i5p,2-ethyl thiophenol,o-ethylbenzenethiol,fema no. 3345,ethylbenzenethiol, o,2-ethylphenylmercaptan,benzenethiol, o-ethyl,o-ethylthiophenol
IUPAC Name 2-ethylbenzenethiol
InChI Key ABROBCBIIWHVNS-UHFFFAOYSA-N
Molecular Formula C8H10S
2,259
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4-Fluoro-1-naphthoic acid, 97%

CAS: 573-03-5 Molecular Formula: C11H7FO2 Molecular Weight (g/mol): 190.173 MDL Number: MFCD00004011 InChI Key: DEWIOKQDRWFLFW-UHFFFAOYSA-N Synonym: 4-fluoro-1-naphthoic acid,1-naphthalenecarboxylic acid, 4-fluoro,4-fluoronaphthalenecarboxylic acid,4-fluoro-1-naphthalenecarboxylic acid,4-fluoro-1-naphthalene carboxylic acid,4-fluoro-naphthalene-1-carboxylic acid,acmc-1atch,maybridge3_003028,ksc270s4j,1-carboxy-4-fluoronaphthalene PubChem CID: 68448 IUPAC Name: 4-fluoronaphthalene-1-carboxylic acid SMILES: C1=CC=C2C(=C1)C(=CC=C2F)C(=O)O

PubChem CID 68448
CAS 573-03-5
Molecular Weight (g/mol) 190.173
MDL Number MFCD00004011
SMILES C1=CC=C2C(=C1)C(=CC=C2F)C(=O)O
Synonym 4-fluoro-1-naphthoic acid,1-naphthalenecarboxylic acid, 4-fluoro,4-fluoronaphthalenecarboxylic acid,4-fluoro-1-naphthalenecarboxylic acid,4-fluoro-1-naphthalene carboxylic acid,4-fluoro-naphthalene-1-carboxylic acid,acmc-1atch,maybridge3_003028,ksc270s4j,1-carboxy-4-fluoronaphthalene
IUPAC Name 4-fluoronaphthalene-1-carboxylic acid
InChI Key DEWIOKQDRWFLFW-UHFFFAOYSA-N
Molecular Formula C11H7FO2
2,260
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4-Aminothiophenol, 96%

CAS: 1193-02-8 Molecular Formula: C6H6NS Molecular Weight (g/mol): 124.18 MDL Number: MFCD00007880 InChI Key: WCDSVWRUXWCYFN-UHFFFAOYSA-M Synonym: 4-aminothiophenol,4-mercaptoaniline,p-aminothiophenol,p-aminobenzenethiol,4-amino thiophenol,benzenethiol, 4-amino,p-mercaptoaniline,benzenethiol, p-amino,p-aminophenylmercaptan,4-aminophenyl mercaptan PubChem CID: 14510 IUPAC Name: 4-aminobenzenethiol SMILES: NC1=CC=C([S-])C=C1

PubChem CID 14510
CAS 1193-02-8
Molecular Weight (g/mol) 124.18
MDL Number MFCD00007880
SMILES NC1=CC=C([S-])C=C1
Synonym 4-aminothiophenol,4-mercaptoaniline,p-aminothiophenol,p-aminobenzenethiol,4-amino thiophenol,benzenethiol, 4-amino,p-mercaptoaniline,benzenethiol, p-amino,p-aminophenylmercaptan,4-aminophenyl mercaptan
IUPAC Name 4-aminobenzenethiol
InChI Key WCDSVWRUXWCYFN-UHFFFAOYSA-M
Molecular Formula C6H6NS
2,261
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Fluorene-2-carboxaldehyde, 99%

CAS: 30084-90-3 Molecular Formula: C14H10O Molecular Weight (g/mol): 194.23 MDL Number: MFCD00001123 InChI Key: MNQGEQSXFDKAPY-UHFFFAOYSA-N Synonym: 2-fluorenecarboxaldehyde,fluorene-2-carboxaldehyde,fluorene-2-carbaldehyde,9h-fluorene-2-carboxaldehyde,2-formylfluorene,2-fluorencarbaldehyd,2-fluorenecarboaldehyde,acmc-1cjjq,4-07-00-01656 beilstein handbook reference,# PubChem CID: 34804 IUPAC Name: 9H-fluorene-2-carbaldehyde SMILES: O=CC1=CC=C2C(CC3=CC=CC=C23)=C1

PubChem CID 34804
CAS 30084-90-3
Molecular Weight (g/mol) 194.23
MDL Number MFCD00001123
SMILES O=CC1=CC=C2C(CC3=CC=CC=C23)=C1
Synonym 2-fluorenecarboxaldehyde,fluorene-2-carboxaldehyde,fluorene-2-carbaldehyde,9h-fluorene-2-carboxaldehyde,2-formylfluorene,2-fluorencarbaldehyd,2-fluorenecarboaldehyde,acmc-1cjjq,4-07-00-01656 beilstein handbook reference,#
IUPAC Name 9H-fluorene-2-carbaldehyde
InChI Key MNQGEQSXFDKAPY-UHFFFAOYSA-N
Molecular Formula C14H10O
2,262
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2-Naphthoxyacetic acid, 97%

CAS: 120-23-0 Molecular Formula: C12H10O3 Molecular Weight (g/mol): 202.209 MDL Number: MFCD00004066 InChI Key: RZCJYMOBWVJQGV-UHFFFAOYSA-N Synonym: 2-naphthoxyacetic acid,2-naphthyloxy acetic acid,bnoa,2-naphthyloxyacetic acid,2-naphthalen-2-yloxy acetic acid,noxa,betoxon,2-noxa,naphthoxyacetic acid,betapal PubChem CID: 8422 ChEBI: CHEBI:50397 IUPAC Name: 2-naphthalen-2-yloxyacetic acid SMILES: C1=CC=C2C=C(C=CC2=C1)OCC(=O)O

PubChem CID 8422
CAS 120-23-0
Molecular Weight (g/mol) 202.209
ChEBI CHEBI:50397
MDL Number MFCD00004066
SMILES C1=CC=C2C=C(C=CC2=C1)OCC(=O)O
Synonym 2-naphthoxyacetic acid,2-naphthyloxy acetic acid,bnoa,2-naphthyloxyacetic acid,2-naphthalen-2-yloxy acetic acid,noxa,betoxon,2-noxa,naphthoxyacetic acid,betapal
IUPAC Name 2-naphthalen-2-yloxyacetic acid
InChI Key RZCJYMOBWVJQGV-UHFFFAOYSA-N
Molecular Formula C12H10O3
2,263
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4-Methoxy-3-nitrobenzaldehyde, 98%

CAS: 31680-08-7 Molecular Formula: C8H7NO4 Molecular Weight (g/mol): 181.15 MDL Number: MFCD00126498 InChI Key: YTCRQCGRYCKYNO-UHFFFAOYSA-N Synonym: 3-nitro-4-anisaldehyde,4-methoxy-3-nitro-benzaldehyde,benzaldehyde, 4-methoxy-3-nitro,3-nitro-4-methoxybenzaldehyde,pubchem8145,3-nitro-p-anisaldehyde,acmc-1adwt,4-methoxy-5-nitrobenzaldehyde,4-methoxy-3-nitrobenzaldehyde PubChem CID: 700608 IUPAC Name: 4-methoxy-3-nitrobenzaldehyde SMILES: COC1=CC=C(C=O)C=C1[N+]([O-])=O

PubChem CID 700608
CAS 31680-08-7
Molecular Weight (g/mol) 181.15
MDL Number MFCD00126498
SMILES COC1=CC=C(C=O)C=C1[N+]([O-])=O
Synonym 3-nitro-4-anisaldehyde,4-methoxy-3-nitro-benzaldehyde,benzaldehyde, 4-methoxy-3-nitro,3-nitro-4-methoxybenzaldehyde,pubchem8145,3-nitro-p-anisaldehyde,acmc-1adwt,4-methoxy-5-nitrobenzaldehyde,4-methoxy-3-nitrobenzaldehyde
IUPAC Name 4-methoxy-3-nitrobenzaldehyde
InChI Key YTCRQCGRYCKYNO-UHFFFAOYSA-N
Molecular Formula C8H7NO4
2,264
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3,5-Diiodosalicylic acid, 97%

CAS: 133-91-5 Molecular Formula: C7H4I2O3 Molecular Weight (g/mol): 389.915 MDL Number: MFCD00002444 InChI Key: DHZVWQPHNWDCFS-UHFFFAOYSA-N Synonym: 3,5-diiodosalicylic acid,3,5-diiodo-2-hydroxybenzoic acid,benzoic acid, 2-hydroxy-3,5-diiodo,2-hydroxy-3,5-diiodobenzoate,3,5-diiodosalicylate,2-hydroxy-3,5-diiodobenzenecarboxylic acid,salicylic acid, 3,5-diiodo,2-hydroxy-3,5-diiodo-benzoic acid,benzoic acid, 3,5-diiodo-2-hydroxy,3,5-diiodosalicylicacid PubChem CID: 8631 IUPAC Name: 2-hydroxy-3,5-diiodobenzoic acid SMILES: C1=C(C=C(C(=C1I)O)C(=O)O)I

PubChem CID 8631
CAS 133-91-5
Molecular Weight (g/mol) 389.915
MDL Number MFCD00002444
SMILES C1=C(C=C(C(=C1I)O)C(=O)O)I
Synonym 3,5-diiodosalicylic acid,3,5-diiodo-2-hydroxybenzoic acid,benzoic acid, 2-hydroxy-3,5-diiodo,2-hydroxy-3,5-diiodobenzoate,3,5-diiodosalicylate,2-hydroxy-3,5-diiodobenzenecarboxylic acid,salicylic acid, 3,5-diiodo,2-hydroxy-3,5-diiodo-benzoic acid,benzoic acid, 3,5-diiodo-2-hydroxy,3,5-diiodosalicylicacid
IUPAC Name 2-hydroxy-3,5-diiodobenzoic acid
InChI Key DHZVWQPHNWDCFS-UHFFFAOYSA-N
Molecular Formula C7H4I2O3
2,265
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3,5-Bis(trifluoromethyl)benzyl alcohol, 98%

CAS: 32707-89-4 Molecular Formula: C9H6F6O Molecular Weight (g/mol): 244.136 MDL Number: MFCD00009907 InChI Key: BJTWPJOGDWRYDD-UHFFFAOYSA-N Synonym: 3,5-bis trifluoromethyl benzyl alcohol,3,5-bis trifluoromethyl phenyl methanol,3,5-bis-trifluoromethyl-phenyl-methanol,3,5-ditrifluoromethylbenzyl alcohol,benzenemethanol, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzylalcohol,3,5-di trifluoromethyl benzyl alcohol,3,5-di trifluoromethyl phenyl methanol,3,5-bis-trifluoromethyl benzyl alcohol PubChem CID: 122933 IUPAC Name: [3,5-bis(trifluoromethyl)phenyl]methanol SMILES: C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CO

PubChem CID 122933
CAS 32707-89-4
Molecular Weight (g/mol) 244.136
MDL Number MFCD00009907
SMILES C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)CO
Synonym 3,5-bis trifluoromethyl benzyl alcohol,3,5-bis trifluoromethyl phenyl methanol,3,5-bis-trifluoromethyl-phenyl-methanol,3,5-ditrifluoromethylbenzyl alcohol,benzenemethanol, 3,5-bis trifluoromethyl,3,5-bis trifluoromethyl benzylalcohol,3,5-di trifluoromethyl benzyl alcohol,3,5-di trifluoromethyl phenyl methanol,3,5-bis-trifluoromethyl benzyl alcohol
IUPAC Name [3,5-bis(trifluoromethyl)phenyl]methanol
InChI Key BJTWPJOGDWRYDD-UHFFFAOYSA-N
Molecular Formula C9H6F6O