1,3-Difluoro-2-propanol

C₃H₆F₂OCAS 453-13-496.08 g/mol

Open in Covalent MOL file

Alcohol Alkyl halide

Properties

Molecular formula: C₃H₆F₂O
Molar mass: 96.08 g/mol
Exact mass: 96.0387 Da
Density: 1.244 g/mL (at 20 °C)
Boiling point: 54–55 °C
logP: 0.29Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Identifiers

CAS number

453-13-4

SMILES

OC(CF)CF

InChIKey

PVDLUGWWIOGCNH-UHFFFAOYSA-N

InChI

InChI=1S/C3H6F2O/c4-1-3(6)2-5/h3,6H,1-2H2

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

5 names

2-Propanol, 1,3-difluoro-
1,3-Difluoropropane-2-ol
1,3-Difluoroisopropanol
NSC 21305
NSC 76034

Work with 1,3-Difluoro-2-propanol

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Cyclododecanol1724-39-641 % similar Cycloheptanol502-41-041 % similar Cyclooctanol696-71-941 % similar Cyclopropanol16545-68-940 % similar 1,3,5-Cyclohexanetriol2041-15-840 % similar 1,4-Cyclohexanediol556-48-940 % similar trans-1,4-Cyclohexanediol6995-79-540 % similar Polyglycerol25618-55-735 % similar

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

Same formula

2,2-Difluoro-1-propanol33420-52-9

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia