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87992-76-5 | Phosphorimidic acid, (dimethoxyphosphinyl)-, dibutyl phenyl ester
CAS No: 87992-76-5 Catalog No: AG004HCO MDL No:
Product Description
Catalog Number:
AG004HCO
Chemical Name:
Phosphorimidic acid, (dimethoxyphosphinyl)-, dibutyl phenyl ester
CAS Number:
87992-76-5
Molecular Formula:
C16H29NO6P2
Molecular Weight:
393.3521
IUPAC Name:
dibutoxy-dimethoxyphosphorylimino-phenoxy-λ5-phosphane
InChI:
InChI=1S/C16H29NO6P2/c1-5-7-14-21-25(22-15-8-6-2,17-24(18,19-3)20-4)23-16-12-10-9-11-13-16/h9-13H,5-8,14-15H2,1-4H3
InChI Key:
SDVPCAONWITPIP-UHFFFAOYSA-N
SMILES:
CCCCOP(=NP(=O)(OC)OC)(Oc1ccccc1)OCCCC
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
393.147g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
393.357g/mol
Monoisotopic Mass:
393.147g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
75.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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