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Substance Name: 3-Indolepropionic acid, 5-chloro-2-methyl-
RN: 73816-52-1
InChIKey: BTGZRYNYFFQYJP-UHFFFAOYSA-N

Molecular Formula

  • C13-H12-Cl-N-O2

Molecular Weight

  • 237.6848
 
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Names and Synonyms

Synonym

  • 5-Chloro-2-methyl-3-indolepropionic acid

Systematic Name

  • 3-Indolepropionic acid, 5-chloro-2-methyl-

Registry Numbers

CAS Registry Number

  • 73816-52-1

System Generated Number

  • 0073816521

Structure Descriptors

InChI

1S/C12H12ClNO2/c1-7-9(3-5-12(15)16)10-6-8(13)2-4-11(10)14-7/h2,4,6,14H,3,5H2,1H3,(H,15,16)

InChIKey

BTGZRYNYFFQYJP-UHFFFAOYSA-N

Smiles

Cc1c(c2cc(ccc2[nH]1)Cl)CCC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 320mg/kg (320mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#04145,