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Substance Name: Alanine, 3-(4-(bis(2-chloroethyl)amino)-3-methoxyphenyl)-
RN: 66902-62-3
InChIKey: PDUXIBFAWGEDRX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H20-Cl2-N2-O3

Molecular Weight

  • 335.229
 
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Names and Synonyms

Synonyms

  • 3-(4-(Bis(2-chloroethyl)amino)-3-methoxyphenyl)alanine
  • 3P
  • p-Bis(2-chloroethyl)amino-o-methoxyphenylalanine

Systematic Name

  • Alanine, 3-(4-(bis(2-chloroethyl)amino)-3-methoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 66902-62-3

System Generated Number

  • 0066902623

Structure Descriptors

InChI

1S/C14H20Cl2N2O3/c1-21-13-9-10(8-11(17)14(19)20)2-3-12(13)18(6-4-15)7-5-16/h2-3,9,11H,4-8,17H2,1H3,(H,19,20)

InChIKey

PDUXIBFAWGEDRX-UHFFFAOYSA-N

Smiles

c1(c(cc(C[C@@H](C(O)=O)N)cc1)OC)N(CCCl)CCCl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 39mg/kg (39mg/kg)   Scientia Sinica. Vol. 13, Pg. 789, 1964.