Mechlorethamine

Structure Molecule image
Relationships Total Number of functionally related protein(s) : 119
Total Number of Articles : 151
PubChem 4033
Molecular Formula

C5H11Cl2N

SMILES

CN(CCCl)CCCl

InChI

InChI=1S/C5H11Cl2N/c1-8(4-2-6)5-3-7/h2-5H2,1H3

synonyms
  • mechlorethamine
  • Chlormethine
  • Nitrogen mustard
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Properties
Property Value
MW 156.05 g/mol
HBD 0
HBA 1
Rotatable Bond Count 4
Exact Mass 155.0268547 g/mol
Monoisotopic Mass 155.0268547 g/mol
Heavy Atom Count 8
Isotope Atom Count 0
Atom Stereo Count 0
Covalent Unit Count 1
Complexity 43.7
xlogp 0.9
Topological Polar Surface Area 3.2