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1186-23-8 | Phosphonic acid, [3-(acetyloxy)propyl]-, diethyl ester
CAS No: 1186-23-8 Catalog No: AG0075R7 MDL No:
Product Description
Catalog Number:
AG0075R7
Chemical Name:
Phosphonic acid, [3-(acetyloxy)propyl]-, diethyl ester
CAS Number:
1186-23-8
Molecular Formula:
C9H19O5P
Molecular Weight:
238.2179
IUPAC Name:
3-diethoxyphosphorylpropyl acetate
InChI:
InChI=1S/C9H19O5P/c1-4-13-15(11,14-5-2)8-6-7-12-9(3)10/h4-8H2,1-3H3
InChI Key:
RRFYWUJZEPKTHW-UHFFFAOYSA-N
SMILES:
CCOP(=O)(OCC)CCCOC(=O)C
Properties
Complexity:
219
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.097g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.22g/mol
Monoisotopic Mass:
238.097g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
61.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5
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