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Home> Hot Product Listed P   > Phosphorothioic acid,O,O-diethyl ester, O-ester with m-hydroxybenzaldehyde oxime (8CI)
1260672-65-8 structure

Phosphorothioic acid,O,O-diethyl ester, O-ester with m-hydroxybenzaldehyde oxime (8CI)

Iupac Name:3,8-dichloro-1,7-naphthyridine
CAS No.:1260672-65-8
Molecular Weight:199.034
Molecular Formula:C12H21N2O3PS2 (isomer)
Names and Identifiers
Synonyms

Benzaldehyde,m-hydroxy-, oxime, O-ester with O,O-diethyl phosphorothioate (8CI)

Inchi
InChI=1S/C8H4Cl2N2/c9-6-3-5-1-2-11-8(10)7(5)12-4-6/h1-4H
InChkey
MBOAAZGQONXYSS-UHFFFAOYSA-N
Canonical Smiles
C1=CN=C(C2=NC=C(C=C21)Cl)Cl
Properties
Boiling Point
229.8°Cat760mmHg
Computational chemical data
  • Molecular Weight:199.034g/mol
  • Molecular Formula:C12H21N2O3PS2
  • Compound Is Canonicalized:True
  • Exact Mass:197.975
  • Monoisotopic Mass:197.975
  • Complexity:165
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:25.8A^2
  • Heavy Atom Count:12
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADcYBzAAAGAAAAAAAAAAAAAAAAAAAAAAAsWAAAAAAAAACx+AAAHAIAAAAADArBHiQ8wPIIEACg AzRnRACCgCQxFyAI2CA4dpgIYOLBk5HUIAhggADIyAcQAAAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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