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15922-01-7 | Benzoic acid, 4-nitro-, potassium salt (1:1)
CAS No: 15922-01-7 Catalog No: AG001QK6 MDL No:MFCD00070536
Product Description
Catalog Number:
AG001QK6
Chemical Name:
Benzoic acid, 4-nitro-, potassium salt (1:1)
CAS Number:
15922-01-7
Molecular Formula:
C7H4KNO4
Molecular Weight:
205.2093
MDL Number:
MFCD00070536
IUPAC Name:
potassium;4-nitrobenzoate
InChI:
InChI=1S/C7H5NO4.K/c9-7(10)5-1-3-6(4-2-5)8(11)12;/h1-4H,(H,9,10);/q;+1/p-1
InChI Key:
MKBKSBKMELRIKB-UHFFFAOYSA-M
SMILES:
[O-]C(=O)c1ccc(cc1)[N+](=O)[O-].[K+]
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.978g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
205.21g/mol
Monoisotopic Mass:
204.978g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
86A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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