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Substance Name: 2H-1,4-Benzoxazin-3(4H)-one, 7-bromo-6-chloro-4-(2,3-dihydroxypropyl)-2-methyl-
RN: 52042-28-1
InChIKey: VXAFCDRTJSDYLC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H13-Br-Cl-N-O4

Molecular Weight

  • 350.5947
 
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Names and Synonyms

Synonyms

  • 2-Methyl-3-oxo-4-(2,3-dihydroxypropyl)-6-chloro-7-bromo-2,3-dihydro-1,4-benzoxazine
  • 7-Bromo-6-chloro-4-(2,3-dihydroxypropyl)-2-methyl-2H-1,4-benzoxazin-3(4H)-one
  • BRN 1222802

Systematic Name

  • 2H-1,4-Benzoxazin-3(4H)-one, 7-bromo-6-chloro-4-(2,3-dihydroxypropyl)-2-methyl-

Registry Numbers

CAS Registry Number

  • 52042-28-1

System Generated Number

  • 0052042281

Structure Descriptors

InChI

1S/C12H13BrClNO4/c1-6-12(18)15(4-7(17)5-16)10-3-9(14)8(13)2-11(10)19-6/h2-3,6-7,16-17H,4-5H2,1H3

InChIKey

VXAFCDRTJSDYLC-UHFFFAOYSA-N

Smiles

CC1C(=O)N(c2cc(c(cc2O1)Br)Cl)CC(CO)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral > 1500mg/kg (1500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 10, Pg. 37, 1975.