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Substance Name: 2,4-Dichloromandelic acid
RN: 7554-78-1
UNII: ZO0484O865
InChIKey: YBOCBYSVZOREGT-UHFFFAOYSA-N

Molecular Formula

  • C8-H6-Cl2-O3

Molecular Weight

  • 221.038
 
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Names and Synonyms

Name of Substance

  • 2,4-Dichloromandelic acid

Synonyms

  • 2,4-Dichloro-alpha-hydroxybenzeneacetic acid
  • 2,4-Dichloromandelic acid
  • 3-10-00-00479 (Beilstein Handbook Reference)
  • BRN 2728753
  • NSC 409412
  • UNII-ZO0484O865

Systematic Names

  • Benzeneacetic acid, 2,4-dichloro-alpha-hydroxy- (9CI)
  • Mandelic acid, 2,4-dichloro-

Registry Numbers

CAS Registry Number

  • 7554-78-1

FDA UNII

  • ZO0484O865

System Generated Number

  • 0007554781

Structure Descriptors

InChI

1S/C8H6Cl2O3/c9-4-1-2-5(6(10)3-4)7(11)8(12)13/h1-3,7,11H,(H,12,13)

InChIKey

YBOCBYSVZOREGT-UHFFFAOYSA-N

Smiles

c1(c(cc(Cl)cc1)Cl)[C@@H](C(O)=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 intraperitoneal 2490mg/kg (2490mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

KIDNEY, URETER, AND BLADDER: URINE VOLUME INCREASED

LUNGS, THORAX, OR RESPIRATION: RESPIRATORY DEPRESSION
Kiso to Rinsho. Clinical Report. Vol. 15, Pg. 539, 1981.