chempirical

1,2-Dibromo-3-chloropropane

C3H5Br2ClCAS 96-12-8236.33 g/mol

Open in Covalent MOL file
ClBrBr
Alkyl halide

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)
logP
2.38Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

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

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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-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 2-Bromo-1-chloropropane3017-95-635 % similar

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

Elsewhere

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