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13005-36-2 | Benzeneacetic acid, potassium salt (1:1)
CAS No: 13005-36-2 Catalog No: AG000TYQ MDL No:MFCD00065944
Product Description
Catalog Number:
AG000TYQ
Chemical Name:
Benzeneacetic acid, potassium salt (1:1)
CAS Number:
13005-36-2
Molecular Formula:
C8H7KO2
Molecular Weight:
174.2383
MDL Number:
MFCD00065944
IUPAC Name:
potassium;2-phenylacetate
InChI:
InChI=1S/C8H8O2.K/c9-8(10)6-7-4-2-1-3-5-7;/h1-5H,6H2,(H,9,10);/q;+1/p-1
InChI Key:
JFOZPCWVLIBFCH-UHFFFAOYSA-M
SMILES:
[O-]C(=O)Cc1ccccc1.[K+]
EC Number:
235-845-6
Properties
Complexity:
119
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
174.008g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
174.24g/mol
Monoisotopic Mass:
174.008g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
40.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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