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14576-54-6 | Propanoic acid, 3-(ethoxyphenylphosphinyl)-, ethyl ester
CAS No: 14576-54-6 Catalog No: AG001DE0 MDL No:
Product Description
Catalog Number:
AG001DE0
Chemical Name:
Propanoic acid, 3-(ethoxyphenylphosphinyl)-, ethyl ester
CAS Number:
14576-54-6
Molecular Formula:
C13H19O4P
Molecular Weight:
270.2613
IUPAC Name:
ethyl 3-[ethoxy(phenyl)phosphoryl]propanoate
InChI:
InChI=1S/C13H19O4P/c1-3-16-13(14)10-11-18(15,17-4-2)12-8-6-5-7-9-12/h5-9H,3-4,10-11H2,1-2H3
InChI Key:
LRSCBHWZLXFDJO-UHFFFAOYSA-N
SMILES:
CCOP(=O)(c1ccccc1)CCC(=O)OCC
Properties
Complexity:
297
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
270.102g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
270.265g/mol
Monoisotopic Mass:
270.102g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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