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89222-55-9 | Phosphonic acid, [1-hydroxy-3-(1-piperidinyl)propyl]-, diethyl ester
CAS No: 89222-55-9 Catalog No: AG0043XF MDL No:
Product Description
Catalog Number:
AG0043XF
Chemical Name:
Phosphonic acid, [1-hydroxy-3-(1-piperidinyl)propyl]-, diethyl ester
CAS Number:
89222-55-9
Molecular Formula:
C12H26NO4P
Molecular Weight:
279.3129
IUPAC Name:
1-diethoxyphosphoryl-3-piperidin-1-ylpropan-1-ol
InChI:
InChI=1S/C12H26NO4P/c1-3-16-18(15,17-4-2)12(14)8-11-13-9-6-5-7-10-13/h12,14H,3-11H2,1-2H3
InChI Key:
FYPFZKWHIJRZFI-UHFFFAOYSA-N
SMILES:
CCOP(=O)(C(CCN1CCCCC1)O)OCC
Properties
Complexity:
259
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
279.16g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
279.317g/mol
Monoisotopic Mass:
279.16g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
59A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
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