1,2-Dibromopropane

C3H6Br2CAS 78-75-1201.89 g/mol

Open in Covalent MOL file
BrBr
Alkyl halide

Properties

Molecular formula
C3H6Br2
Molar mass
201.89 g/mol
Exact mass
199.8836 Da
Density
1.9245 g/mL (at 20 °C)
Melting point
−55.2 °C
Boiling point
141.9 °C
Flash point
-75 °C
logP
2.16Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
1

Hazards

Warning
Flammable (GHS02)Irritant (GHS07)Environmental Hazard (GHS09)

Aggregated from 49 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, P273, P280, P301+P317, P302+P352, P303+P361+P353, P304+P340, P305+P351+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P370+P378, P391, P403+P235, P501

Identifiers

CAS number
78-75-1
SMILES
CC(Br)CBr
InChIKey
XFNJYAKDBJUJAJ-UHFFFAOYSA-N
InChI
InChI=1S/C3H6Br2/c1-3(5)2-4/h3H,2H2,1H3

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Names and synonyms

3 names
  • Propane, 1,2-dibromo-
  • Propylene dibromide
  • 2,3-Dibromopropane

Work with 1,2-Dibromopropane

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

2,4-Dibromopentane19398-53-953 % similar 2,5-Dibromohexane24774-58-153 % similar 1,3-Dibromobutane107-80-250 % similar 2-Bromobutane78-76-247 % similar 1,4-Dibromopentane626-87-945 % similar 2-Bromo-1-chloropropane3017-95-645 % similar 1-Bromo-2-methylpropane78-77-344 % similar 2-Bromopentane107-81-343 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1,3-Dibromopropane109-64-8

Elsewhere

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