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89552-73-8 | Phosphinothioic acid,bis(tetrahydro-1(2H)-pyridazinyl)-, O-phenyl ester (9CI)
CAS No: 89552-73-8 Catalog No: AG003ZNH MDL No:
Product Description
Catalog Number:
AG003ZNH
Chemical Name:
Phosphinothioic acid,bis(tetrahydro-1(2H)-pyridazinyl)-, O-phenyl ester (9CI)
CAS Number:
89552-73-8
Molecular Formula:
C14H23N4OPS
Molecular Weight:
326.3974
IUPAC Name:
bis(diazinan-1-yl)-phenoxy-sulfanylidene-λ5-phosphane
InChI:
InChI=1S/C14H23N4OPS/c21-20(17-12-6-4-10-15-17,18-13-7-5-11-16-18)19-14-8-2-1-3-9-14/h1-3,8-9,15-16H,4-7,10-13H2
InChI Key:
WBYZROFSPHZNIR-UHFFFAOYSA-N
SMILES:
S=P(N1CCCCN1)(N1CCCCN1)Oc1ccccc1
NSC Number:
362655
Properties
Complexity:
356
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
326.133g/mol
Formal Charge:
0
Heavy Atom Count:
21
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
326.399g/mol
Monoisotopic Mass:
326.133g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
71.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9
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