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131721-21-6 | Phosphonic acid, (2-oxodecyl)-, diethyl ester (9CI)
CAS No: 131721-21-6 Catalog No: AG000ZMR MDL No:
Product Description
Catalog Number:
AG000ZMR
Chemical Name:
Phosphonic acid, (2-oxodecyl)-, diethyl ester (9CI)
CAS Number:
131721-21-6
Molecular Formula:
C14H29O4P
Molecular Weight:
292.3514
IUPAC Name:
1-diethoxyphosphoryldecan-2-one
InChI:
InChI=1S/C14H29O4P/c1-4-7-8-9-10-11-12-14(15)13-19(16,17-5-2)18-6-3/h4-13H2,1-3H3
InChI Key:
FIAPXLGOCRSZGX-UHFFFAOYSA-N
SMILES:
CCCCCCCCC(=O)CP(=O)(OCC)OCC
Properties
Complexity:
269
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
292.18g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
292.356g/mol
Monoisotopic Mass:
292.18g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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