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10088-45-6 | Phosphonic acid, P-phenyl-, monomethyl ester
CAS No: 10088-45-6 Catalog No: AG00033N MDL No:
Product Description
Catalog Number:
AG00033N
Chemical Name:
Phosphonic acid, P-phenyl-, monomethyl ester
CAS Number:
10088-45-6
Molecular Formula:
C7H8O3P-
Molecular Weight:
171.1104
IUPAC Name:
methoxy(phenyl)phosphinic acid
InChI:
InChI=1S/C7H9O3P/c1-10-11(8,9)7-5-3-2-4-6-7/h2-6H,1H3,(H,8,9)
InChI Key:
ZWBALHRZGYPNNG-UHFFFAOYSA-N
SMILES:
COP(=O)(c1ccccc1)[O-]
Properties
Complexity:
163
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
172.029g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
172.12g/mol
Monoisotopic Mass:
172.029g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Characterization of human cytochrome P450 induction by pesticides. | Toxicology 20120329 |
| On the question of stepwise vs. concerted cleavage of RNA models promoted by a synthetic dinuclear Zn(II) complex in methanol: implementation of a noncleavable phosphonate probe. | Organic & biomolecular chemistry 20100221 |
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