Home Carboxys 1,10-Phenanthroline-2,9-dicarboxylic acid, 5-nitro-

1,10-Phenanthroline-2,9-dicarboxylic acid, 5-nitro-

CAS No.:
164394-23-4
Catalog Number:
AG001UUY
Molecular Formula:
C14H7N3O6
Molecular Weight:
313.2219
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Product Description
Catalog Number:
AG001UUY
Chemical Name:
1,10-Phenanthroline-2,9-dicarboxylic acid, 5-nitro-
CAS Number:
164394-23-4
Molecular Formula:
C14H7N3O6
Molecular Weight:
313.2219
MDL Number:
MFCD00209668
IUPAC Name:
5-nitro-1,10-phenanthroline-2,9-dicarboxylic acid
InChI:
InChI=1S/C14H7N3O6/c18-13(19)8-3-1-6-5-10(17(22)23)7-2-4-9(14(20)21)16-12(7)11(6)15-8/h1-5H,(H,18,19)(H,20,21)
InChI Key:
XZQXNUFLUBLEIO-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc2c(n1)c1nc(ccc1c(c2)[N+](=O)[O-])C(=O)O
Properties
Complexity:
521  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.033g/mol
Formal Charge:
0
Heavy Atom Count:
23  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
313.225g/mol
Monoisotopic Mass:
313.033g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
146A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties