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Home > Nitro Compounds > 7531-39-7
7531-39-7 | 4-nitrophenyl diethylphosphinate
CAS No: 7531-39-7 Catalog No: AG005CAW MDL No:
Product Description
Catalog Number:
AG005CAW
Chemical Name:
4-nitrophenyl diethylphosphinate
CAS Number:
7531-39-7
Molecular Formula:
C10H14NO4P
Molecular Weight:
243.1962
IUPAC Name:
1-diethylphosphoryloxy-4-nitrobenzene
InChI:
InChI=1S/C10H14NO4P/c1-3-16(14,4-2)15-10-7-5-9(6-8-10)11(12)13/h5-8H,3-4H2,1-2H3
InChI Key:
DOJNLTSZOHKYAA-UHFFFAOYSA-N
SMILES:
CCP(=O)(Oc1ccc(cc1)[N+](=O)[O-])CC
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.066g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.199g/mol
Monoisotopic Mass:
243.066g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
72.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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