1-Bromo-2-propanol

C3H7BrOCAS 19686-73-8138.99 g/mol

Open in Covalent MOL file
HOBr
AlcoholAlkyl halide

Properties

Molecular formula
C3H7BrO
Molar mass
138.99 g/mol
Exact mass
137.9680 Da
Density
1.5585 g/mL (at 30 °C)
Melting point
−55 °C
Boiling point
146.5 °C
Flash point
54.4 °C
Water solubility
≥ 100 g/L (22.2 °C)
logP
0.76Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
1

Hazards

Not classified as hazardous under GHS by 57 ECHA notifiers. Aggregated from 57 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Identifiers

CAS number
19686-73-8
SMILES
CC(O)CBr
InChIKey
WEGOLYBUWCMMMY-UHFFFAOYSA-N
InChI
InChI=1S/C3H7BrO/c1-3(5)2-4/h3,5H,2H2,1H3

Weigh it out

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

Names and synonyms

6 names
  • 2-Propanol, 1-bromo-
  • 2-Hydroxy-2-methylethyl bromide
  • 2-Hydroxypropyl bromide
  • 1-Bromo-2-hydroxypropane
  • Propylene bromohydrin
  • (±)-1-Bromo-2-propanol

Work with 1-Bromo-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

(2R,5R)-2,5-Hexanediol17299-07-950 % similar 2,5-Hexanediol2935-44-650 % similar (2S,5S)-(+)-Hexanediol34338-96-050 % similar (2R,4R)-(-)-Pentanediol42075-32-150 % similar 2,4-Pentanediol625-69-450 % similar (2S,4S)-(+)-Pentanediol72345-23-450 % similar (-)-2-Butanol14898-79-445 % similar (+-)-2-Butanol15892-23-645 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Bromo-1-propanol627-18-9 Bromoethyl methyl ether6482-24-2 Amberlyst 159037-24-5

Elsewhere

PubChem CAS Common Chemistry NIST WebBook