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113537-76-1 | Propanedioic acid, 2-[2-(diethoxyphosphino)ethyl]-, 1,3-diethyl ester
CAS No: 113537-76-1 Catalog No: AG0008X1 MDL No:
Product Description
Catalog Number:
AG0008X1
Chemical Name:
Propanedioic acid, 2-[2-(diethoxyphosphino)ethyl]-, 1,3-diethyl ester
CAS Number:
113537-76-1
Molecular Formula:
C13H25O6P
Molecular Weight:
308.3078
IUPAC Name:
diethyl 2-(2-diethoxyphosphanylethyl)propanedioate
InChI:
InChI=1S/C13H25O6P/c1-5-16-12(14)11(13(15)17-6-2)9-10-20(18-7-3)19-8-4/h11H,5-10H2,1-4H3
InChI Key:
WKJOZFZPEPSWNA-UHFFFAOYSA-N
SMILES:
CCOP(CCC(C(=O)OCC)C(=O)OCC)OCC
Properties
Complexity:
260
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.139g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.311g/mol
Monoisotopic Mass:
308.139g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
71.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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