1,3-Difluoro-2-propanol

C3H6F2OCAS 453-13-496.08 g/mol

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OHFF
AlcoholAlkyl 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 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)

Aggregated from 47 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P233, P240, P241, P242, P243, P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P403+P233, P403+P235, P405, P501

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

Cyclopentanol96-41-344 % similar Cyclohexanol108-93-041 % similar 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

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