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Home > Nitro Compounds > 30309-78-5
30309-78-5 | Phosphinic acid, bis(5-nitro-o-tolyl)- (6CI,8CI)
CAS No: 30309-78-5 Catalog No: AG002ZLR MDL No:
Product Description
Catalog Number:
AG002ZLR
Chemical Name:
Phosphinic acid, bis(5-nitro-o-tolyl)- (6CI,8CI)
CAS Number:
30309-78-5
Molecular Formula:
C14H13N2O6P
Molecular Weight:
336.2366
IUPAC Name:
bis(2-methyl-5-nitrophenyl)phosphinic acid
InChI:
InChI=1S/C14H13N2O6P/c1-9-3-5-11(15(17)18)7-13(9)23(21,22)14-8-12(16(19)20)6-4-10(14)2/h3-8H,1-2H3,(H,21,22)
InChI Key:
WXBOLJNHJSEAHM-UHFFFAOYSA-N
SMILES:
Cc1cc(ccc1P(=O)(c1ccc(cc1C)[N+](=O)[O-])O)[N+](=O)[O-]
Properties
Complexity:
474
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.051g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
336.24g/mol
Monoisotopic Mass:
336.051g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
129A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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