chempirical

1-Chloro-3-methoxypropane

C4H9ClOCAS 36215-07-3108.57 g/mol

Open in Covalent MOL file
OCl
Alkyl halideEther

Properties

Molecular formula
C4H9ClO
Molar mass
108.57 g/mol
Exact mass
108.0342 Da
Density
1.0009 g/mL (at 20 °C)
Melting point
110–112 °C
Boiling point
111 °C
logP
1.26Crippen estimate
Polar surface area
9.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
3

Identifiers

CAS number
36215-07-3
SMILES
COCCCCl
InChIKey
BQLHMMQUVJCTAN-UHFFFAOYSA-N
InChI
InChI=1S/C4H9ClO/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-chloro-3-methoxy-
  • Ether, 3-chloropropyl methyl
  • 3-Chloro-1-methoxypropane
  • 3-Chloropropyl methyl ether
  • 3-Methoxypropyl chloride
  • 3-Methoxy-1-chloropropane
  • Methyl 3-chloropropyl ether

Work with 1-Chloro-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

1-Chloro-4-methoxybutane17913-18-783 % similar 2-Chloroethyl methyl ether627-42-967 % 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-Bromo-3-methoxypropane36865-41-545 % similar

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

Same formula

t-Butyl hypochlorite507-40-4 1-Chloro-2-methyl-2-propanol558-42-9 1-Chloro-2-ethoxyethane628-34-2 4-Chloro-1-butanol928-51-8

Elsewhere

PubChem CAS Common Chemistry NIST WebBook