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147357-66-2 | Phosphorous acid, methyl bis(4-nitrophenyl) ester
CAS No: 147357-66-2 Catalog No: AG001EUC MDL No:
Product Description
Catalog Number:
AG001EUC
Chemical Name:
Phosphorous acid, methyl bis(4-nitrophenyl) ester
CAS Number:
147357-66-2
Molecular Formula:
C13H11N2O7P
Molecular Weight:
338.2094
IUPAC Name:
methyl bis(4-nitrophenyl) phosphite
InChI:
InChI=1S/C13H11N2O7P/c1-20-23(21-12-6-2-10(3-7-12)14(16)17)22-13-8-4-11(5-9-13)15(18)19/h2-9H,1H3
InChI Key:
WWLGNJSOIRYUIJ-UHFFFAOYSA-N
SMILES:
COP(Oc1ccc(cc1)[N+](=O)[O-])Oc1ccc(cc1)[N+](=O)[O-]
Properties
Complexity:
362
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.03g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
338.212g/mol
Monoisotopic Mass:
338.03g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
119A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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