chempirical

1-Bromo-3-methoxypropane

C4H9BrOCAS 36865-41-5153.02 g/mol

Open in Covalent MOL file
OBr
Alkyl halideEther

Properties

Molecular formula
C4H9BrO
Molar mass
153.02 g/mol
Exact mass
151.9837 Da
Density
1.3592 g/mL (at 20 °C)
Boiling point
132–133 °C
logP
1.42Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Identifiers

CAS number
36865-41-5
SMILES
COCCCBr
InChIKey
CEVMYGZHEJSOHZ-UHFFFAOYSA-N
InChI
InChI=1S/C4H9BrO/c1-6-4-2-3-5/h2-4H2,1H3

Weigh it out

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

Names and synonyms

7 names
  • Propane, 1-bromo-3-methoxy-
  • Ether, 3-bromopropyl methyl
  • 3-Methoxy-1-bromopropane
  • 3-Methoxypropyl bromide
  • 3-Bromopropyl methyl ether
  • 3-Bromo-1-methoxypropane
  • 1-Methoxy-3-bromopropane

Work with 1-Bromo-3-methoxypropane

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

Bromoethyl methyl ether6482-24-267 % similar 1-Bromo-2-(2-methoxyethoxy)ethane54149-17-655 % similar Dipropylene glycol dimethyl ether111109-77-450 % similar Butyl methyl ether628-28-448 % similar Dimethoxyethane110-71-447 % similar Polyethylene glycol dimethyl ether24991-55-747 % similar 3-Methoxy-1-propanol1589-49-745 % similar 1-Chloro-3-methoxypropane36215-07-345 % similar

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

Same formula

4-Bromo-1-butanol33036-62-3 2-Bromoethyl ethyl ether592-55-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook