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3699-67-0 | Ethyl 3-(diethoxyphosphoryl)propanoate
CAS No: 3699-67-0 Catalog No: AG0035QK MDL No:MFCD00015167
Product Description
Catalog Number:
AG0035QK
Chemical Name:
Ethyl 3-(diethoxyphosphoryl)propanoate
CAS Number:
3699-67-0
Molecular Formula:
C9H19O5P
Molecular Weight:
238.2179
MDL Number:
MFCD00015167
IUPAC Name:
ethyl 3-diethoxyphosphorylpropanoate
InChI:
InChI=1S/C9H19O5P/c1-4-12-9(10)7-8-15(11,13-5-2)14-6-3/h4-8H2,1-3H3
InChI Key:
JMJWCUOIOKBVNQ-UHFFFAOYSA-N
SMILES:
CCOC(=O)CCP(=O)(OCC)OCC
NSC Number:
133823
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:
0.4
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