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80395-16-0 | Phosphonic acid, [(3-fluorophenyl)methyl]-
CAS No: 80395-16-0 Catalog No: AG0053CO MDL No:MFCD29036999
Product Description
Catalog Number:
AG0053CO
Chemical Name:
Phosphonic acid, [(3-fluorophenyl)methyl]-
CAS Number:
80395-16-0
Molecular Formula:
C7H8FO3P
Molecular Weight:
190.1088
MDL Number:
MFCD29036999
IUPAC Name:
(3-fluorophenyl)methylphosphonic acid
InChI:
InChI=1S/C7H8FO3P/c8-7-3-1-2-6(4-7)5-12(9,10)11/h1-4H,5H2,(H2,9,10,11)
InChI Key:
FEASAQQGBIZVJR-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)CP(=O)(O)O
Properties
Complexity:
191
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.02g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
190.11g/mol
Monoisotopic Mass:
190.02g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
57.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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