1,2-Dibromopropane

C₃H₆Br₂CAS 78-75-1201.89 g/mol

Open in Covalent MOL file

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
logP: 2.16Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 1

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

Weigh it out

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

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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