4-[Bis(2-chloroethyl)amino]benzoic acid

CAS Registry Number®

1141-37-3

CAS Name

4-[Bis(2-chloroethyl)amino]benzoic acid

Molecular Formula

C11H13Cl2NO2

Molecular Mass

262.13

Cite this Page

4-[Bis(2-chloroethyl)amino]benzoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1141-37-3 (retrieved 2024-11-25) (CAS RN: 1141-37-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    168-169 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H13Cl2NO2/c12-5-7-14(8-6-13)10-3-1-9(2-4-10)11(15)16/h1-4H,5-8H2,(H,15,16)

InChIKey

InChIKey=PCLQMXVMRDPVKX-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • Benzoic acid, 4-[bis(2-chloroethyl)amino]-
  • Benzoic acid, p-[bis(2-chloroethyl)amino]-
  • 4-[Bis(2-chloroethyl)amino]benzoic acid
  • p-[N,N-Bis(2-chloroethyl)amino]benzoic acid
  • p-[Bis(2-chloroethyl)amino]benzoic acid

View All

CAS INSIGHTSTM
Hourglass and a clock