1,2-Dibromo-3-chloropropane

C₃H₅Br₂ClCAS 96-12-8236.33 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₃H₅Br₂Cl
Molar mass: 236.33 g/mol
Exact mass: 233.8447 Da
Density: 2.08 g/mL (at 20 °C)
Melting point: 5 °C
Boiling point: 164.5 °C (at 300 Torr)
Flash point: 76.7 °C (open cup)
Water solubility: 1 g/L
logP: 2.38Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 2

Hazards

Danger

H301 Toxic if swallowedAcute toxicity, oral
H340 May cause genetic defectsGerm cell mutagenicity
H350 May cause cancerCarcinogenicity
H360F *** May damage fertilityReproductive toxicity
H373 ** May causes damage to organs through prolonged or repeated exposureSpecific target organ toxicity, repeated exposure
H412 Harmful to aquatic life with long lasting effectsHazardous to the aquatic environment, long-term hazard

Harmonised EU classification (CLP Annex VI, index 602-021-00-6), via PubChem.

Precautionary statements

P203, P260, P264, P270, P273, P280, P301+P316, P318, P319, P321, P330, P405, P501

Identifiers

CAS number

96-12-8

SMILES

ClCC(Br)CBr

InChIKey

WBEJYOJJBDISQU-UHFFFAOYSA-N

InChI

InChI=1S/C3H5Br2Cl/c4-1-3(5)2-6/h3H,1-2H2

Weigh it out

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

Names and synonyms

16 names · show all

Propane, 1,2-dibromo-3-chloro-
OS 1897
Nemafume
Fumazone
Nemagon
Nemagon soil fumigant
Nemapaz
Nemazon
DBCP
Nemagon 90
Nemagon 20
Nemagon 20G
Dibromochloropropane
3-Chloro-1,2-dibromopropane
1-Chloro-2,3-dibromopropane
NSC 1512

Work with 1,2-Dibromo-3-chloropropane

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

1,2,3-Tribromopropane96-11-759 % similar 1,2-Dibromobutane533-98-245 % similar 2,3-Dibromo-1-propanol96-13-945 % similar 1-Bromo-3-chloro-2-methylpropane6974-77-243 % similar Tris(2,3-dibromopropyl) phosphate126-72-736 % similar Tris(2,3-dibromopropyl) isocyanurate52434-90-936 % similar 1,2,3,4-Tetrabromobutane1529-68-635 % similar 1,1,2-Tribromoethane78-74-035 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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