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16761-12-9 | Heptanoic acid, potassium salt (1:1)
CAS No: 16761-12-9 Catalog No: AG001XHL MDL No:
Product Description
Catalog Number:
AG001XHL
Chemical Name:
Heptanoic acid, potassium salt (1:1)
CAS Number:
16761-12-9
Molecular Formula:
C7H13KO2
Molecular Weight:
168.2752
IUPAC Name:
potassium;heptanoate
InChI:
InChI=1S/C7H14O2.K/c1-2-3-4-5-6-7(8)9;/h2-6H2,1H3,(H,8,9);/q;+1/p-1
InChI Key:
YOSXTSJZQNTKKX-UHFFFAOYSA-M
SMILES:
CCCCCCC(=O)[O-].[K+]
EC Number:
240-820-8
Properties
Complexity:
83.7
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.055g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.277g/mol
Monoisotopic Mass:
168.055g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
40.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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