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14657-64-8 | Propanoic acid, 3-(hydroxyphenylphosphinyl)-
CAS No: 14657-64-8 Catalog No: AG001E5W MDL No:MFCD08704562
Product Description
Catalog Number:
AG001E5W
Chemical Name:
Propanoic acid, 3-(hydroxyphenylphosphinyl)-
CAS Number:
14657-64-8
Molecular Formula:
C9H11O4P
Molecular Weight:
214.1550
MDL Number:
MFCD08704562
IUPAC Name:
3-[hydroxy(phenyl)phosphoryl]propanoic acid
InChI:
InChI=1S/C9H11O4P/c10-9(11)6-7-14(12,13)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,10,11)(H,12,13)
InChI Key:
MORLYCDUFHDZKO-UHFFFAOYSA-N
SMILES:
OC(=O)CCP(=O)(c1ccccc1)O
Properties
Complexity:
245
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
214.039g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
214.157g/mol
Monoisotopic Mass:
214.039g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
74.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.1
Literature
| Title | Journal |
|---|---|
| Melaminium (2-carboxyethyl)(phenyl)phosphinate monohydrate. | Acta crystallographica. Section C, Crystal structure communications 20120901 |
| Novel second-harmonic-generation-active lead(II) phosphinate based on 2-carboxyethyl(phenyl)phosphinate ligand. | Dalton transactions (Cambridge, England : 2003) 20110928 |
| Two polymorphs of (2-carboxyethyl)(phenyl)phosphinic acid. | Acta crystallographica. Section C, Crystal structure communications 20110601 |
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