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85672-93-1 | Acetic acid, [ethoxy(4-phenylbutyl)phosphinyl]-, methyl ester
CAS No: 85672-93-1 Catalog No: AG004Q6A MDL No:
Product Description
Catalog Number:
AG004Q6A
Chemical Name:
Acetic acid, [ethoxy(4-phenylbutyl)phosphinyl]-, methyl ester
CAS Number:
85672-93-1
Molecular Formula:
C15H23O4P
Molecular Weight:
298.3145
IUPAC Name:
methyl 2-[ethoxy(4-phenylbutyl)phosphoryl]acetate
InChI:
InChI=1S/C15H23O4P/c1-3-19-20(17,13-15(16)18-2)12-8-7-11-14-9-5-4-6-10-14/h4-6,9-10H,3,7-8,11-13H2,1-2H3
InChI Key:
FSRIBQVJWKHIHX-UHFFFAOYSA-N
SMILES:
CCOP(=O)(CC(=O)OC)CCCCc1ccccc1
Properties
Complexity:
324
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
298.133g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
298.319g/mol
Monoisotopic Mass:
298.133g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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