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L-Ascorbic acid (calcium dihydrate) (Standard)

CAT: 0804-HY-B0166CRSize: 1 EachDry Ice: NoHazardous: No
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Description
L-Ascorbic acid (calcium dihydrate) (Standard) is the analytical standard of L-Ascorbic acid (calcium dihydrate) . This product is intended for research and analytical applications. L-Ascorbic acid (calcium dihydrate) (L-Ascorbate (calcium dihydrate) ; Vitamin C (calcium dihydrate) ) is a biochemical reagent that can be used as a biological material or organic compound for life science related research.
CAS Number
5743-28-2
Product Name Alternative
L-Ascorbate (calcium dihydrate) (Standard) ; Vitamin C (calcium dihydrate) (Standard)
UNSPSC
12352005
Target
Biochemical Assay Reagents; Reference Standards
Type
Reference Standards
Related Pathways
Others
Field of Research
Others; Cancer
Assay Protocol
https://www.medchemexpress.com/l-ascorbic-acid-calcium-dihydrate-standard.html
Smiles
OC([C@@]1([H])[C@H](CO)O)=C(O)C(O1)=O.O.[0.5Ca].O
Molecular Formula
C6H12Ca0.5O8
Molecular Weight
232.19
Shipping Conditions
Room temperature
Scientific Category
Reference Standards

Chemical Information

Calcium ascorbate dihydrate

See also: L-Ascorbic acid, calcium salt, hydrate (2:1:2) (annotation moved to).

CAS Number5743-28-2
PubChem CID54682536
IUPAC Namecalcium;bis((2R)-2-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-5-oxo-2H-furan-4-olate);dihydrate
Molecular FormulaC12H18CaO14
Molecular Weight426.34
Topological Polar Surface Area222
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count14
Rotatable Bond Count4
Heavy Atom Count27
Formal Charge0
Complexity232
SMILES
C([C@@H]([C@@H]1C(=C(C(=O)O1)[O-])O)O)O.C([C@@H]([C@@H]1C(=C(C(=O)O1)[O-])O)O)O.O.O.[Ca+2]
InChI
InChI=1S/2C6H8O6.Ca.2H2O/c2*7-1-2(8)5-3(9)4(10)6(11)12-5;;;/h2*2,5,7-10H,1H2;;2*1H2/q;;+2;;/p-2/t2*2-,5+;;;/m00.../s1
InChIKey
RGJHWLDSRIHFKY-FWCDDDAWSA-L
Chemical Structure
2D Structure
2D structure of Calcium ascorbate dihydrate
CAS: 5743-28-2
CID: 54682536
Formula: C12H18CaO14
MW: 426.34
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight426.34
Hydrogen Bond Donor Count8
Hydrogen Bond Acceptor Count14
Rotatable Bond Count4
Exact Mass426.0322461
Monoisotopic Mass426.0322461
Topological Polar Surface Area222 Ų
Heavy Atom Count27
Formal Charge0
Complexity232
Isotope Atom Count0
Defined Atom Stereocenter Count4
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count5
Compound Is CanonicalizedYes