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2112-28-9 | Benzamide, 2,5-dinitro-
CAS No: 2112-28-9 Catalog No: AG002L7V MDL No:
Product Description
Catalog Number:
AG002L7V
Chemical Name:
Benzamide, 2,5-dinitro-
CAS Number:
2112-28-9
Molecular Formula:
C7H5N3O5
Molecular Weight:
211.1317
IUPAC Name:
2,5-dinitrobenzamide
InChI:
InChI=1S/C7H5N3O5/c8-7(11)5-3-4(9(12)13)1-2-6(5)10(14)15/h1-3H,(H2,8,11)
InChI Key:
CWTFEEDMVMXTDU-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(c1)C(=O)N)[N+](=O)[O-]
NSC Number:
519077
Properties
Complexity:
294
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.023g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
211.133g/mol
Monoisotopic Mass:
211.023g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
135A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.7
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