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Home > Pyridines > 176220-38-5
176220-38-5 | Phosphonic acid, P,P'-[[2,2'-bipyridine]-4,4'-diylbis(methylene)]bis-, P,P,P',P'-tetraethyl ester
CAS No: 176220-38-5 Catalog No: AG0024I7 MDL No:MFCD09751186
Product Description
Catalog Number:
AG0024I7
Chemical Name:
Phosphonic acid, P,P'-[[2,2'-bipyridine]-4,4'-diylbis(methylene)]bis-, P,P,P',P'-tetraethyl ester
CAS Number:
176220-38-5
Molecular Formula:
C20H30N2O6P2
Molecular Weight:
456.4095
MDL Number:
MFCD09751186
IUPAC Name:
4-(diethoxyphosphorylmethyl)-2-[4-(diethoxyphosphorylmethyl)pyridin-2-yl]pyridine
InChI:
InChI=1S/C20H30N2O6P2/c1-5-25-29(23,26-6-2)15-17-9-11-21-19(13-17)20-14-18(10-12-22-20)16-30(24,27-7-3)28-8-4/h9-14H,5-8,15-16H2,1-4H3
InChI Key:
OQVYMXCRDHDTTH-UHFFFAOYSA-N
SMILES:
CCOP(=O)(Cc1ccnc(c1)c1nccc(c1)CP(=O)(OCC)OCC)OCC
Properties
Complexity:
524
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
456.158g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
456.416g/mol
Monoisotopic Mass:
456.158g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
96.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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