Calcium L-ascorbate dihydrate

CAT: 1596-AR-A04748-01Size: 50 UnitsDry Ice: NoHazardous: No

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CAT#:1596-AR-A04748-01Size:50 Units

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CAS Number

5743-28-2

Synonyms

Calcium ascorbate, Calcium di[ (R) -2-[ (S) -1,2-dihydroxyethyl]-4-hydroxy-5-oxo-2H-furan-3-olate] dihydrate

Molecular Weight

462.37

API Name

Calcium Ascorbate

Chemical Information

Calcium ascorbate dihydrate

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

CAS Number	5743-28-2
PubChem CID	54682536
IUPAC Name	calcium;bis((2R)-2-[(1S)-1,2-dihydroxyethyl]-3-hydroxy-5-oxo-2H-furan-4-olate);dihydrate
Molecular Formula	C12H18CaO14
Molecular Weight	426.34
Topological Polar Surface Area	222
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	4
Heavy Atom Count	27
Formal Charge	0
Complexity	232

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

CAS: 5743-28-2

CID: 54682536

Formula: C12H18CaO14

MW: 426.34

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	426.34
Hydrogen Bond Donor Count	8
Hydrogen Bond Acceptor Count	14
Rotatable Bond Count	4
Exact Mass	426.0322461
Monoisotopic Mass	426.0322461
Topological Polar Surface Area	222 Å²
Heavy Atom Count	27
Formal Charge	0
Complexity	232
Isotope Atom Count	0
Defined Atom Stereocenter Count	4
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	5
Compound Is Canonicalized	Yes

Catalog	Name
AR-M03064-01	Calcium Ascorbate
AR-P01811-01	Calcium Phosphate Dibasic Dihydrate
AR-T03363-01	Disodium L- (+) -Tartrate Dihydrate
AR-H07593-01	Bis (L-Histidinato) Zinc Dihydrate
AR-P01828-01	L- (-) -Phosphonic Acid Calcium
AR-L13589-01	L-Methylfolate Calcium Salt
AR-P31471-01	L- (-) -Phosphonic Acid Calcium
AR-P01154-01	Calcium (D, L) -Pantoate
AR-P30274-01	Calcium (D, L) -Pantoate
AR-C05830-01	L-Gluconic Acid Calcium Salt

Catalog	Name
sc-257212	Calcium L-ascorbate dihydrate
TRC-C145025-5G	Calcium Ascorbate Dihydrate
443783-01	Calcium Ascorbate Dihydrate, USP
HY-B0166C	L-Ascorbic acid (calcium dihydrate)
GTR19245534-01	L-Ascorbic acid calcium dihydrate
278382-01	L-Glyceric acid calcium salt dihydrate
HY-B0166CR	L-Ascorbic acid (calcium dihydrate) (Standard)
12535-01	L-Ascorbic Acid Calcium Salt Dihydrate extrapure, 99%
JH912894	Calcium Ascorbate
CB0265	Calcium sulfate, dihydrate