{4-[Bis(2-Chloroethyl)Amino]Phenoxy}Acetic Acid

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Properties Simple | Detailed

Formula C12H15Cl2NO3
IUPAC Name 2-[4-[bis(2-chloroethyl)amino]phenoxy]acetic acid
Molecular Mass 292.158 g·mol−1
Heat of Formation -527.3 ± 16.7 kJ·mol−1
Dipole Moment 1.88 ± 1.08 D
Volume 326.36 Å 3
Surface Area 298.02 Å 2
HOMO Energy -8.41 ± 0.55 eV
LUMO Energy -0.03 ± eV
Point Group Symmetry C1
Synonyms
  • (p-(bis(2-chloroethyl)amino)phenoxy)acetic acid
  • 2-[4-[bis(2-chloroethyl)amino]phenoxy]ethanoic acid
  • 4-n,n-bis(2-chloroethyl)aminophenoxyacetic acid
  • acetic acid, (4-(bis(2-chloroethyl)amino)phenoxy)-
  • acetic acid, (4-bis(2-chloroethyl)amino)phenoxy- (9ci)
  • acetic acid, (p-(bis(2-chloroethyl)amino)phenoxy)-
  • acetic acid, (p-[bis(2-chloroethyl)amino]phenoxy)-
  • acetic acid, [4-bis(2-chloroethyl)amino]phenoxy-
  • cb 1360
  • mp 571
  • p-n,n-bis(2-chloroethyl)aminophenoxyacetic acid
  • p-n,n-bis(2-chlroethyl)aminophenoxyacetic acid
CAS Number(s)
  • 17528-53-9
InChIKey IVWVTSYBZDGRSH-UHFFFAOYSA-N
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Elements H C N O Cl