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methyl(4-nitrophenoxy)phosphinic acid

methyl(4-nitrophenoxy)phosphinic acid

CAS: 1832-64-0

Formula: C7H8NO5P

SMILES: CP(O)(=O)OC1=CC=C(C=C1)[N+]([O-])=O

IUPAC: methyl(4-nitrophenoxy)phosphinic acid

InChI: InChI=1S/C7H8NO5P/c1-14(11,12)13-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,11,12)

Composition: C (38.72%), H (3.71%), N (6.45%), O (36.84%), P (14.27%)

Molar Mass: 217.117

Atom Count: 22

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 1
Asymmetric Atom Count 0
Exact Mass 217.01400936
Formal Charge 0
FSP3 0.14
Hetero Ring Count 0
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey VJPXTXIEAOSJBR-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 47.76
Topological Polar Surface Area 89.67
Polarizability 18.65
Ring Count 1
Rotatable Bond Count 3

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