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209664-72-2 | Benzoic acid, 2-amino-5-nitro-, potassium salt (1:1)
CAS No: 209664-72-2 Catalog No: AG002KCU MDL No:
Product Description
Catalog Number:
AG002KCU
Chemical Name:
Benzoic acid, 2-amino-5-nitro-, potassium salt (1:1)
CAS Number:
209664-72-2
Molecular Formula:
C7H5KN2O4
Molecular Weight:
220.2239
IUPAC Name:
potassium;2-amino-5-nitrobenzoate
InChI:
InChI=1S/C7H6N2O4.K/c8-6-2-1-4(9(12)13)3-5(6)7(10)11;/h1-3H,8H2,(H,10,11);/q;+1/p-1
InChI Key:
VUOPWTVKTDYMCB-UHFFFAOYSA-M
SMILES:
[O-]C(=O)c1cc(ccc1N)[N+](=O)[O-].[K+]
Properties
Complexity:
220
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
219.989g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
220.225g/mol
Monoisotopic Mass:
219.989g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
112A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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