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Basic Information
CAS No.: 1030-06-4
Name: Chlorambucil sodium salt
Molecular Structure:
Molecular Structure of 1030-06-4 (Chlorambucil sodium salt)
Formula: C14H19 Cl2 N O2 . Na
Molecular Weight: 327.23
Synonyms: Benzenebutanoicacid, 4-[bis(2-chloroethyl)amino]-, sodium salt (9CI); Butyric acid,4-[p-[bis(2-chloroethyl)amino]phenyl]-, sodium salt (8CI); Chlorambucil sodiumsalt; Sodium chlorambucil
Density: g/cm3
Boiling Point: 460.1°Cat760mmHg
Flash Point: 232.1°C
Safety: Poison by an unspecified route. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of Cl−, NOx, and Na2O. See also CHLORAMBUCIL.
PSA: 43.37000
LogP: 2.04320
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Chemistry

IUPAC Name: sodium 4-[4-[bis(2-chloroethyl)amino]phenyl]butanoate
Synonyms of Chlorambucil sodium salt (CAS NO.1030-06-4): CB 1348 sodium salt ;  Sodium chlorambucil ; p-(Di-2-chloroethylamine)-phenyl butyric acid sodium salt ; p-N,N-Bis(2-chloroethyl)aminophenylbutyric acid sodium salt ; Benzenebutanoic acid, 4-(bis(2-chloroethyl)amino)-, sodium salt (9CI) ; Butyric acid, 4-(p-(bis(2-chloroethyl)amino)phenyl)-, sodium salt
CAS NO: 1030-06-4
Molecular Formula of Chlorambucil sodium salt (CAS NO.1030-06-4): C14H18Cl2NNaO2
Molecular Weight: 326.194
Molecular Structure:

H bond acceptors: 3
H bond donors: 1
Freely Rotating Bonds: 9
Polar Surface Area: 40.54 Å2
Flash Point of Chlorambucil sodium salt (CAS NO.1030-06-4): 232.1 °C
Enthalpy of Vaporization: 75.94 kJ/mol
Boiling Point: 460.1 °C at 760 mmHg
Vapour Pressure: 2.92E-09 mmHg at 25°C

Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 unreported 45mg/kg (45mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 11, Pg. 437, 1956.

Consensus Reports

EPA Genetic Toxicology Program.

Safety Profile

Poison by an unspecified route. Experimental reproductive effects. Mutation data reported. When heated to decomposition it emits toxic fumes of Cl−, NOx, and Na2O. See also CHLORAMBUCIL.