Compound Summary for: CID 61248     Try the new version summary page

Molecular Formula: C3H5KO3   Molecular Weight: 128.1683   InChIKey: PHZLMBHDXVLRIX-UHFFFAOYSA-M
Compound Information
CID 61248
Create Date: 2005-08-08
Suppressed Compound
Properties and Descriptors
Properties
Molecular Weight 128.1683 [g/mol]
Molecular FormulaC3H5KO3
H-Bond Donor1
H-Bond Acceptor3
Rotatable Bond Count0
Exact Mass127.987576
MonoIsotopic Mass127.987576
Topological Polar Surface Area60.4
Heavy Atom Count7
Formal Charge0
Complexity53.5
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Descriptors
IUPAC Namepotassium;2-hydroxypropanoate
InChIInChI=1S/C3H6O3.K/c1-2(4)3(5)6;/h2,4H,1H3,(H,5,6);/q;+1/p-1
InChIKeyPHZLMBHDXVLRIX-UHFFFAOYSA-M
Canonical SMILESCC(C(=O)[O-])O.[K+]
Isomeric SMILESCC(C(=O)[O-])O.[K+]
Old Version Substance Information