chempirical

1,2-Dichloropropane

C3H6Cl2CAS 78-87-5112.98 g/mol

Open in Covalent MOL file
ClCl
Alkyl halide

Properties

Molecular formula
C3H6Cl2
Molar mass
112.98 g/mol
Exact mass
111.9847 Da
Density
1.159 g/mL (at 25 °C)
Melting point
−100.4 °C
Boiling point
96.4 °C
logP
1.85Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Identifiers

CAS number
78-87-5
SMILES
CC(Cl)CCl
InChIKey
KNKRKFALVUDBJE-UHFFFAOYSA-N
InChI
InChI=1S/C3H6Cl2/c1-3(5)2-4/h3H,2H2,1H3

Weigh it out

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

Names and synonyms

6 names
  • Propane, 1,2-dichloro-
  • Propylene chloride
  • Propylene dichloride
  • 1,2-DCP
  • R 270Da
  • NSC 1237

Work with 1,2-Dichloropropane

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

1,3-Dichlorobutane1190-22-350 % similar 2-Chlorobutane78-86-447 % similar Propylene chlorohydrin78-89-745 % similar Isobutyl chloride513-36-044 % similar 1,1,2-Trichloroethane79-00-539 % similar 1,2,3-Trichloropropane96-18-439 % similar Bis(2-chloro-1-methylethyl) ether108-60-138 % similar 1-Chloro-2-propanol127-00-438 % similar

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

Same formula

1,3-Dichloropropane142-28-9 2,2-Dichloropropane594-20-7

Elsewhere

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