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Betaine Hydrochloride

CAT: 0203-04815-75Size: 500 gDry Ice: NoHazardous: No
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CAT#:0203-04815-75Size:500 g
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CAS Number
590-46-5
Storage Conditions
Room temperature

Chemical Information

Betaine chloride

Betaine Hydrochloride is the hydrochloride form of betaine, a crystalline alkaloid occurring in sugar beets and other plants. Betaine, acting as a transmethylating metabolic intermediate, is the oxidation product of choline. Betaine hydrochloride is used as a gastric acidifier supplement.

CAS Number590-46-5
PubChem CID11545
IUPAC Namecarboxymethyl(trimethyl)azanium chloride
Molecular FormulaC5H12ClNO2
Molecular Weight153.61
Topological Polar Surface Area37.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count9
Formal Charge0
Complexity93
SMILES
C[N+](C)(C)CC(=O)O.[Cl-]
InChI
InChI=1S/C5H11NO2.ClH/c1-6(2,3)4-5(7)8;/h4H2,1-3H3;1H
InChIKey
HOPSCVCBEOCPJZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Betaine chloride
CAS: 590-46-5
CID: 11545
Formula: C5H12ClNO2
MW: 153.61
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight153.61
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass153.0556563
Monoisotopic Mass153.0556563
Topological Polar Surface Area37.3 Ų
Heavy Atom Count9
Formal Charge0
Complexity93.1
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
N1700-5.1Betaine hydrochloride
A14540-5000Betaine hydrochloride 5g

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