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30725-71-4 | Dithiophosphoric acid O,O-diethyl S-(2,3-dihydro-2-oxobenzoxazol-3-ylmethyl) ester
CAS No: 30725-71-4 Catalog No: AG00BRVT MDL No:
Product Description
Catalog Number:
AG00BRVT
Chemical Name:
Dithiophosphoric acid O,O-diethyl S-(2,3-dihydro-2-oxobenzoxazol-3-ylmethyl) ester
CAS Number:
30725-71-4
IUPAC Name:
3-(diethoxyphosphinothioylsulfanylmethyl)-1,3-benzoxazol-2-one
InChI:
InChI=1S/C12H16NO4PS2/c1-3-15-18(19,16-4-2)20-9-13-10-7-5-6-8-11(10)17-12(13)14/h5-8H,3-4,9H2,1-2H3
InChI Key:
YAAFKGCBOCRHIF-UHFFFAOYSA-N
Properties
Complexity:
386
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
333.026g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
333.357g/mol
Monoisotopic Mass:
333.026g/mol
Rotatable Bond Count:
7
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7
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