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

CAS Registry Number®

10477-72-2

CAS Name

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

Molecular Formula

C12H15Cl2NO2

Molecular Mass

276.16

Cite this Page

4-[Bis(2-chloroethyl)amino]benzeneacetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=10477-72-2 (retrieved 2024-11-24) (CAS RN: 10477-72-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    105 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H15Cl2NO2/c13-5-7-15(8-6-14)11-3-1-10(2-4-11)9-12(16)17/h1-4H,5-9H2,(H,16,17)

InChIKey

InChIKey=RQAFMLCWWGDNLI-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(O)CC1=CC=C(C=C1)N(CCCl)CCCl

Other Names for this Substance

  • Benzeneacetic acid, 4-[bis(2-chloroethyl)amino]-
  • Acetic acid, [p-[bis(2-chloroethyl)amino]phenyl]-
  • 4-[Bis(2-chloroethyl)amino]benzeneacetic acid
  • Chlorphenacyl
  • N,N-Bis(2-chloroethyl)-p-aminophenylacetic acid

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