B14205
3-Benzoylpyridine
97%
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About This Item
Empirical Formula (Hill Notation):
C12H9NO
CAS Number:
Molecular Weight:
183.21
UNSPSC Code:
12352100
PubChem Substance ID:
EC Number:
226-561-3
MDL number:
assay
97%
bp
307 °C (lit.)
mp
36-40 °C (lit.)
SMILES string
O=C(c1ccccc1)c2cccnc2
InChI
1S/C12H9NO/c14-12(10-5-2-1-3-6-10)11-7-4-8-13-9-11/h1-9H
InChI key
RYMBAPVTUHZCNF-UHFFFAOYSA-N
Storage Class
13 - Non Combustible Solids
wgk
WGK 3
flash_point_f
302.0 °F - closed cup
flash_point_c
150 °C - closed cup
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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M Murray et al.
Chemico-biological interactions, 113(3), 161-173 (1998-08-26)
3-Benzoylpyridine (3BP) is a major metabolite of HGG-12, and oxime that has been synthesized as a potential antidote to the toxic effects of soman and other anticholinesterases. Structural similarities exist between 3BP, the cytochrome P450 (CYP)-inducer metyrapone (MET) and other
P Eyer et al.
Xenobiotica; the fate of foreign compounds in biological systems, 13(11), 649-659 (1983-11-01)
3-Benzoylpyridine (3-BP), a decomposition product of the soman antidote, HGG-12 (3-benzoylpyridino(1)-methyl 2'-hydroxyiminomethylpyridino(1')methyl ether dichloride) was rapidly metabolized in the isolated perfused rat liver, giving 3-(alpha-hydroxybenzyl)pyridine and its corresponding glucuronide, 3-benzoylpyridine-N-oxide, and 3-(alpha-hydroxybenzyl)pyridine-N-oxide. The latter is formed both from 3-(alpha-hydroxybenzyl)pyridine and
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