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Home > Nitro Compounds > 86536-52-9
86536-52-9 | Phosphonic acid, [(nitrophenyl)methyl]-
CAS No: 86536-52-9 Catalog No: AG004LX6 MDL No:
Product Description
Catalog Number:
AG004LX6
Chemical Name:
Phosphonic acid, [(nitrophenyl)methyl]-
CAS Number:
86536-52-9
Molecular Formula:
C7H8NO5P
Molecular Weight:
217.1159
IUPAC Name:
(2-nitrophenyl)methylphosphonic acid
InChI:
InChI=1S/C7H8NO5P/c9-8(10)7-4-2-1-3-6(7)5-14(11,12)13/h1-4H,5H2,(H2,11,12,13)
InChI Key:
HBWJOOJRCPIQEI-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccccc1CP(=O)(O)O
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
217.014g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
217.117g/mol
Monoisotopic Mass:
217.014g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
103A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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