Home Nitros 3,5-Dinitroanthanilic acid

3,5-Dinitroanthanilic acid

CAS No.:
609-97-2
Catalog Number:
AG00EV6J
Molecular Formula:
C7H5N3O6
Molecular Weight:
227.1311
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Product Description
Catalog Number:
AG00EV6J
Chemical Name:
3,5-Dinitroanthanilic acid
CAS Number:
609-97-2
Molecular Formula:
C7H5N3O6
Molecular Weight:
227.1311
MDL Number:
MFCD00157004
IUPAC Name:
2-amino-3,5-dinitrobenzoic acid
InChI:
InChI=1S/C7H5N3O6/c8-6-4(7(11)12)1-3(9(13)14)2-5(6)10(15)16/h1-2H,8H2,(H,11,12)
InChI Key:
RLIOZFXFZKCBIG-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc(C(=O)O)c(c(c1)[N+](=O)[O-])N
Properties
Complexity:
321  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
227.018g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
227.132g/mol
Monoisotopic Mass:
227.018g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
155A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties