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89095-24-9 | Phosphinic acid, methyl[2-(3-pyridinyl)-1-piperidinyl]-, ethyl ester
CAS No: 89095-24-9 Catalog No: AG003ZYV MDL No:
Product Description
Catalog Number:
AG003ZYV
Chemical Name:
Phosphinic acid, methyl[2-(3-pyridinyl)-1-piperidinyl]-, ethyl ester
CAS Number:
89095-24-9
Molecular Formula:
C13H21N2O2P
Molecular Weight:
268.2918
IUPAC Name:
3-[1-[ethoxy(methyl)phosphoryl]piperidin-2-yl]pyridine
InChI:
InChI=1S/C13H21N2O2P/c1-3-17-18(2,16)15-10-5-4-8-13(15)12-7-6-9-14-11-12/h6-7,9,11,13H,3-5,8,10H2,1-2H3
InChI Key:
RSPYHOFXMSECSX-UHFFFAOYSA-N
SMILES:
CCOP(=O)(N1CCCCC1c1cccnc1)C
Properties
Complexity:
311
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
268.134g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
268.297g/mol
Monoisotopic Mass:
268.134g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
2
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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