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147318-10-3 | Acetic acid, 2-(diethoxyphosphinyl)-, octyl ester
CAS No: 147318-10-3 Catalog No: AG001ESV MDL No:
Product Description
Catalog Number:
AG001ESV
Chemical Name:
Acetic acid, 2-(diethoxyphosphinyl)-, octyl ester
CAS Number:
147318-10-3
Molecular Formula:
C14H29O5P
Molecular Weight:
308.3508
IUPAC Name:
octyl 2-diethoxyphosphorylacetate
InChI:
InChI=1S/C14H29O5P/c1-4-7-8-9-10-11-12-17-14(15)13-20(16,18-5-2)19-6-3/h4-13H2,1-3H3
InChI Key:
MXMDTVDDOYHTLF-UHFFFAOYSA-N
SMILES:
CCCCCCCCOC(=O)CP(=O)(OCC)OCC
Properties
Complexity:
283
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
308.175g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
308.355g/mol
Monoisotopic Mass:
308.175g/mol
Rotatable Bond Count:
14
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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