chempirical

1-((3-Trifluoromethyl)phenyl)propanol-1

C10H11F3OCAS 618-97-3204.19 g/mol

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FFFHO
AlcoholAlkyl halide

Properties

Molecular formula
C10H11F3O
Molar mass
204.19 g/mol
Exact mass
204.0762 Da
logP
3.15Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
618-97-3
SMILES
CCC(C1=CC(=CC=C1)C(F)(F)F)O
InChIKey
SZSJCUKIEPGUMF-UHFFFAOYSA-N
InChI
InChI=1S/C10H11F3O/c1-2-9(14)7-4-3-5-8(6-7)10(11,12)13/h3-6,9,14H,2H2,1H3

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Names and synonyms

1 names
  • 1-[3-(Trifluoromethyl)phenyl]propanol-1

Work with 1-((3-Trifluoromethyl)phenyl)propanol-1

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Alpha-methyl-3-(trifluoromethyl)benzyl alcohol454-91-159 % similar 3-(Trifluoromethyl)benzhydrol728-80-355 % similar 3,4'-Bis(trifluoromethyl)benzhydrol203915-48-454 % similar (+)-1-Phenyl-1-propanol1565-74-853 % similar (S)-1-Phenylpropanol613-87-653 % similar 1-Phenyl-1-propanol93-54-953 % similar (R)-1-[3-(Trifluoromethyl)phenyl]ethylamine127852-30-651 % similar 3,5-Bis(trifluoromethyl)benzene402-31-347 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-(Trifluoromethyl)benzenepropanol78573-45-2

Elsewhere

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