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117927-83-0 | Phosphonic acid, P-benzoyl-, monomethyl ester
CAS No: 117927-83-0 Catalog No: AG000I1F MDL No:
Product Description
Catalog Number:
AG000I1F
Chemical Name:
Phosphonic acid, P-benzoyl-, monomethyl ester
CAS Number:
117927-83-0
Molecular Formula:
C8H8O4P-
Molecular Weight:
199.1205
IUPAC Name:
benzoyl(methoxy)phosphinate
InChI:
InChI=1S/C8H9O4P/c1-12-13(10,11)8(9)7-5-3-2-4-6-7/h2-6H,1H3,(H,10,11)/p-1
InChI Key:
ZOCJMJWPRNIOOS-UHFFFAOYSA-M
SMILES:
COP(=O)(C(=O)c1ccccc1)[O-]
Properties
Complexity:
224
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
199.016g/mol
Formal Charge:
-1
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
199.122g/mol
Monoisotopic Mass:
199.016g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
66.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3
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