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59631-23-1 | pyridathion
CAS No: 59631-23-1 Catalog No: AG00F29V MDL No:
Product Description
Catalog Number:
AG00F29V
Chemical Name:
pyridathion
CAS Number:
59631-23-1
IUPAC Name:
5-[ethoxy(propan-2-yloxy)phosphinothioyl]oxy-4-methoxy-2-methylpyridazin-3-one
InChI:
InChI=1S/C11H19N2O5PS/c1-6-16-19(20,17-8(2)3)18-9-7-12-13(4)11(14)10(9)15-5/h7-8H,6H2,1-5H3
InChI Key:
NHUNFKZUEHLVER-UHFFFAOYSA-N
NSC Number:
334649
Properties
Complexity:
477
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
322.075g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
322.316g/mol
Monoisotopic Mass:
322.075g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
102A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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