2-Chloroethyl 4-[bis(2-chloroethyl)amino]benzenebutanoate

CAS Registry Number®

94236-91-6

CAS Name

2-Chloroethyl 4-[bis(2-chloroethyl)amino]benzenebutanoate

Molecular Formula

C16H22Cl3NO2

Molecular Mass

366.71

Cite this Page

2-Chloroethyl 4-[bis(2-chloroethyl)amino]benzenebutanoate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=94236-91-6 (retrieved 2024-11-29) (CAS RN: 94236-91-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C16H22Cl3NO2/c17-8-11-20(12-9-18)15-6-4-14(5-7-15)2-1-3-16(21)22-13-10-19/h4-7H,1-3,8-13H2

InChIKey

InChIKey=DUPWPMRXQCYAKW-UHFFFAOYSA-N

SMILES

N(CCCl)(CCCl)C1=CC=C(CCCC(OCCCl)=O)C=C1

Canonical SMILES

O=C(OCCCl)CCCC1=CC=C(C=C1)N(CCCl)CCCl

Other Names for this Substance

  • Benzenebutanoic acid, 4-[bis(2-chloroethyl)amino]-, 2-chloroethyl ester
  • 2-Chloroethyl 4-[bis(2-chloroethyl)amino]benzenebutanoate

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