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Substance Name: Brevicide Y2
RN: 12705-20-3
InChIKey: ZKYALRSZGHMWMS-PVRNWPCDSA-N

Molecular Formula

  • C18-H12-N2-O4

Molecular Weight

  • 320.3028
 
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Names and Synonyms

Synonym

  • Brevicid Y2

Systematic Name

  • Brevicide Y2

Registry Numbers

CAS Registry Number

  • 12705-20-3

System Generated Number

  • 0012705203

Structure Descriptors

InChI

1S/C18H12N2O4/c1-19-13(7-11-3-5-15(21)17(23)9-11)14(20-2)8-12-4-6-16(22)18(24)10-12/h3-10,21-24H/b13-7-,14-8-

InChIKey

ZKYALRSZGHMWMS-PVRNWPCDSA-N

Smiles

[C-]#[N+]/C(=C\c1cc(c(cc1)O)O)/C(=C/c2cc(c(cc2)O)O)/[N+]#[C-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 20500ug/kg (20.5mg/kg)   Pharmazie. Vol. 21, Pg. 217, 1966.
mouse LD50 intravenous 18mg/kg (18mg/kg)   Pharmazie. Vol. 21, Pg. 217, 1966.
mouse LD50 oral 100mg/kg (100mg/kg)   Pharmazie. Vol. 21, Pg. 217, 1966.