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Calcium Propionate 98% Extrapure

CAT: 1507-00662 00500Size: 500 mgDry Ice: NoHazardous: No
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CAT#:1507-00662 00500Size:500 mg
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CAS Number
4075-81-4

Chemical Information

Calcium propionate
CAS Number4075-81-4
PubChem CID19999
IUPAC Namecalcium propanoate
Molecular FormulaC6H10CaO4
Molecular Weight186.22
Topological Polar Surface Area80.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Heavy Atom Count11
Formal Charge0
Complexity34
SMILES
CCC(=O)[O-].CCC(=O)[O-].[Ca+2]
InChI
InChI=1S/2C3H6O2.Ca/c2*1-2-3(4)5;/h2*2H2,1H3,(H,4,5);/q;;+2/p-2
InChIKey
BCZXFFBUYPCTSJ-UHFFFAOYSA-L
Chemical Structure
2D Structure
2D structure of Calcium propionate
CAS: 4075-81-4
CID: 19999
Formula: C6H10CaO4
MW: 186.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight186.22
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count0
Exact Mass186.0204996
Monoisotopic Mass186.0204996
Topological Polar Surface Area80.3 Ų
Heavy Atom Count11
Formal Charge0
Complexity34.6
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count3
Compound Is CanonicalizedYes