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132424-98-7 | Propanoic acid, 3-cyano-3-(diethoxyphosphinyl)-, ethyl ester
CAS No: 132424-98-7 Catalog No: AG0010OG MDL No:
Product Description
Catalog Number:
AG0010OG
Chemical Name:
Propanoic acid, 3-cyano-3-(diethoxyphosphinyl)-, ethyl ester
CAS Number:
132424-98-7
Molecular Formula:
C10H18NO5P
Molecular Weight:
263.2274
IUPAC Name:
ethyl 3-cyano-3-diethoxyphosphorylpropanoate
InChI:
InChI=1S/C10H18NO5P/c1-4-14-10(12)7-9(8-11)17(13,15-5-2)16-6-3/h9H,4-7H2,1-3H3
InChI Key:
NWLFKZXXFCHIBM-UHFFFAOYSA-N
SMILES:
CCOC(=O)CC(P(=O)(OCC)OCC)C#N
Properties
Complexity:
325
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.092g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.23g/mol
Monoisotopic Mass:
263.092g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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