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114929-91-8 | Pentanoic acid, 2-(diethoxyphosphinyl)-4-oxo-, ethyl ester
CAS No: 114929-91-8 Catalog No: AG000FGL MDL No:
Product Description
Catalog Number:
AG000FGL
Chemical Name:
Pentanoic acid, 2-(diethoxyphosphinyl)-4-oxo-, ethyl ester
CAS Number:
114929-91-8
Molecular Formula:
C11H21O6P
Molecular Weight:
280.2546
IUPAC Name:
ethyl 2-diethoxyphosphoryl-4-oxopentanoate
InChI:
InChI=1S/C11H21O6P/c1-5-15-11(13)10(8-9(4)12)18(14,16-6-2)17-7-3/h10H,5-8H2,1-4H3
InChI Key:
PYYUVOOVTMGHRU-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(P(=O)(OCC)OCC)CC(=O)C
Properties
Complexity:
318
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
280.108g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
280.257g/mol
Monoisotopic Mass:
280.108g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
78.9A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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