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Substance Name: Acetic acid, 2-(N,N-bis(2-chloroethyl)aminophenyl)-, butyl ester
RN: 66232-25-5
InChIKey: BAKGUOSIFRQDLJ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H23-Cl2-N-O2

Molecular Weight

  • 332.269
 
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Names and Synonyms

Synonyms

  • 2-(N,N-Bis(2-chloroethyl)aminophenyl)acetic acid butyl ester
  • BRN 2879160

Systematic Name

  • Acetic acid, 2-(N,N-bis(2-chloroethyl)aminophenyl)-, butyl ester

Registry Numbers

CAS Registry Number

  • 66232-25-5

System Generated Number

  • 0066232255

Structure Descriptors

InChI

1S/C16H23Cl2NO2/c1-2-3-12-21-16(20)13-14-4-6-15(7-5-14)19(10-8-17)11-9-18/h4-7H,2-3,8-13H2,1H3

InChIKey

BAKGUOSIFRQDLJ-UHFFFAOYSA-N

Smiles

c1(N(CCCl)CCCl)ccc(CC(OCCCC)=O)cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 15mg/kg (15mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 205, 1978.
rat LD50 oral 20mg/kg (20mg/kg)   Pharmaceutical Chemistry Journal Vol. 12, Pg. 205, 1978.