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Substance Name: 3-Indolemethanol, 5-nitro-alpha-(trifluoromethyl)-
RN: 101832-03-5
InChIKey: IIQOJMXNXDESET-UHFFFAOYSA-N

Molecular Formula

  • C10-H7-F3-N2-O3

Molecular Weight

  • 260.17
 
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Names and Synonyms

Synonym

  • 1-(5-Nitro-3-indolyl)-2-trifluoroethyl alcohol

Systematic Name

  • 3-Indolemethanol, 5-nitro-alpha-(trifluoromethyl)-

Registry Numbers

CAS Registry Number

  • 101832-03-5

System Generated Number

  • 0101832035

Structure Descriptors

InChI

1S/C10H7F3N2O3/c11-10(12,13)9(16)7-4-14-8-2-1-5(15(17)18)3-6(7)8/h1-4,9,14,16H

InChIKey

IIQOJMXNXDESET-UHFFFAOYSA-N

Smiles

c12c(c[nH]c1ccc(c2)[N+](=O)[O-])[C@@H](C(F)(F)F)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 141mg/kg (141mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#12180,