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Substance Name: Benzoxazole, 2-amino-6-chloro-
RN: 52112-68-2
InChIKey: QDMXVLGVKMTTIT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C7-H5-Cl-N2-O

Molecular Weight

  • 168.583
 
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Names and Synonyms

Synonyms

  • 2-Amino-6-chlorobenzoxazole
  • 6-Chloro-2-benzoxazolamine
  • NSC 24991

Systematic Names

  • 2-Benzoxazolamine, 6-chloro- (9CI)
  • Benzoxazole, 2-amino-6-chloro-

Registry Numbers

CAS Registry Number

  • 52112-68-2

System Generated Number

  • 0052112682

Structure Descriptors

InChI

1S/C7H5ClN2O/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10)

InChIKey

QDMXVLGVKMTTIT-UHFFFAOYSA-N

Smiles

c12c(oc(n1)N)cc(Cl)cc2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 347mg/kg (347mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 336, 1964.
mouse LD50 oral 600mg/kg (600mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 336, 1964.
rat LD50 intraperitoneal 123mg/kg (123mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 338, 1964.
rat LD50 oral 226mg/kg (226mg/kg)   Medicinal Chemistry: A Series of Monographs. Vol. 4(1), Pg. 338, 1964.