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Merck
CN

B7045

Betaine hydrochloride

BioUltra, ≥99%

Synonym(s):

(Carboxymethyl)trimethylammonium hydrochloride

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About This Item

Linear Formula:
(CH3)3N+CH2COOH · Cl-
CAS Number:
Molecular Weight:
153.61
EC Number:
209-683-1
UNSPSC Code:
12352202
PubChem Substance ID:
Beilstein/REAXYS Number:
3916181
MDL number:
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product line

BioUltra

assay

≥99%

impurities

≤0.0005% Phosphorus (P), ≤0.1% Insoluble matter

ign. residue

≤0.1%

mp

241-242 °C (lit.)

solubility

H2O: 1 M, clear, colorless

anion traces

sulfate (SO42-): ≤0.05%

cation traces

Al: ≤0.0005%, Ca: ≤0.0005%, Cu: ≤0.0005%, Fe: ≤0.0005%, K: ≤0.005%, Mg: ≤0.0005%, NH4+: ≤0.05%, Na: ≤0.05%, Pb: ≤0.001%, Zn: ≤0.0005%

SMILES string

[Cl-].C[N+](C)(C)CC(O)=O

InChI

1S/C5H11NO2.ClH/c1-6(2,3)4-5(7)8;/h4H2,1-3H3;1H

InChI key

HOPSCVCBEOCPJZ-UHFFFAOYSA-N

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Biochem/physiol Actions

End-product of oxidative metabolism of choline, betaine is a general methyl donor, in particular in a minor pathway of methionine biosynthesis. It is used to treat homocystinuria, which is a defect in the major pathway of methionine biosynthesis.

pictograms

Corrosion

signalword

Danger

hcodes

Hazard Classifications

Eye Dam. 1

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Bernd C Schwahn et al.
The Biochemical journal, 382(Pt 3), 831-840 (2004-06-26)
MTHFR (methylenetetrahydrofolate reductase) catalyses the synthesis of 5-methyltetrahydrofolate, the folate derivative utilized in homocysteine remethylation to methionine. A severe deficiency of MTHFR results in hyperhomocysteinaemia and homocystinuria. Betaine supplementation has proven effective in ameliorating the biochemical abnormalities and the clinical
Jun Ying et al.
PloS one, 8(2), e54561-e54561 (2013-02-06)
Evidence from human and animal research indicates that choline metabolic pathways may be activated during a variety of diseases, including cancer. We report results of a case-control study of 2821 lung cancer cases and 2923 controls that assessed associations of
A mysterious case of dysphagia demystified by medication reconciliation.
Karthik Ragunathan et al.
The American journal of medicine, 126(6), e1-e1 (2013-05-21)
Weijia Xie et al.
Diabetes, 62(6), 2141-2150 (2013-02-05)
Circulating metabolites associated with insulin sensitivity may represent useful biomarkers, but their causal role in insulin sensitivity and diabetes is less certain. We previously identified novel metabolites correlated with insulin sensitivity measured by the hyperinsulinemic-euglycemic clamp. The top-ranking metabolites were
Michael D Swartz et al.
PloS one, 8(1), e53475-e53475 (2013-02-02)
Folate metabolism, with its importance to DNA repair, provides a promising region for genetic investigation of lung cancer risk. This project investigates genes (MTHFR, MTR, MTRR, CBS, SHMT1, TYMS), folate metabolism related nutrients (B vitamins, methionine, choline, and betaine) and

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