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Weight304.217 g/mol
FormulaC14H19Cl2NO2
Hydrogen Acceptors2
Hydrogen Donors1
Aromatic Rings1
Rotatable Bonds9

chlorambucil (305-03-3)

Leukeran  ·  CB 1348  ·  Lympholysin

Score: #120 in Biochemistry , #521 in Biology , #551 in Chemistry
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Areas of Application

Safety

  • H341: Suspected of causing genetic defects
    Warning Germ cell mutagenicity - Category 2
  • H360: May damage fertility or the unborn child
    Danger Reproductive toxicity - Category 1A, 1B
  • H372: Causes damage to organs through prolonged or repeated exposure
    Danger Specific target organ toxicity, repeated exposure - Category 1

Trends

Alternate Names

  • Leukeran
  • CB 1348
  • Lympholysin
  • Chlorbutin
  • N,N-Di-(2-chloroethyl)-p-aminophenylbutyric Acid
  • CB1348
  • Amboclorin
  • CB-1348
  • NSC 3088
  • Chloraminophene
  • NSC-3088
  • NSC3088
  • 4-(Bis(2-chloroethyl)amino)benzenebutanoic Acid
  • SMILES
    C1=CC(=CC=C1CCCC(=O)O)N(CCCl)CCCl
  • InChIKey
    JCKYGMPEJWAADB-UHFFFAOYSA-N

Estimated Properties

Boiling Point 352.95 C EPA T.E.S.T.
Density 1.28 g/cm3 EPA T.E.S.T.
Flash Point 246.21 C EPA T.E.S.T.
Water Solubility 335.87 mg/L EPA T.E.S.T.

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Synthesis

N,N-Bis(2-chloroethyl)aniline  +  4-CHLOROBUTYRIC ACID (Friedel-Crafts alkylation)
Reactant  +  Bis(2-chloroethyl)amine (Chan-Lam coupling reaction)
Synthesis of chlorambucil ›

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