ChemicalBook--->CAS DataBase List--->731002-50-9

731002-50-9

731002-50-9 Structure

731002-50-9 Structure
IdentificationBack Directory
[Name]

3-hydroxy-4-(trifluoromethyl)benzonitrile
[CAS]

731002-50-9
[Synonyms]

Benzonitrile, 3-hydroxy-4-(trifluoromethyl)-
[Molecular Formula]

C8H4F3NO
[MDL Number]

MFCD16999170
[MOL File]

731002-50-9.mol
[Molecular Weight]

187.12
Chemical PropertiesBack Directory
[Melting point ]

188-189 °C(Solv: dichloromethane (75-09-2))
[Boiling point ]

244.7±40.0 °C(Predicted)
[density ]

1.44±0.1 g/cm3(Predicted)
[pka]

6.60±0.35(Predicted)
[InChI]

InChI=1S/C8H4F3NO/c9-8(10,11)6-2-1-5(4-12)3-7(6)13/h1-3,13H
[InChIKey]

PDMCDRCXQZBLGY-UHFFFAOYSA-N
[SMILES]

C(#N)C1=CC=C(C(F)(F)F)C(O)=C1
Safety DataBack Directory
[HS Code ]

2926907090
Spectrum DetailBack Directory
[Spectrum Detail]

3-hydroxy-4-(trifluoromethyl)benzonitrile(731002-50-9)1HNMR
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