Grundinformationen
- CAS
590-46-5- Standard-SMILES
C[N+](C)(C)CC(=O)O.[Cl-]- InChIKey
HOPSCVCBEOCPJZ-UHFFFAOYSA-N- Summenformel
- C5H12NO2.Cl
- Durchschnittliche Molmasse
- 153,61 g/mol
- Monoisotopische Masse
- 153,0556563
Überblick
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.
Namen und Bezeichner
- Bevorzugter Name
- Betaine chloride
- IUPAC
- carboxymethyl(trimethyl)azanium chloride
- Lokaler Name
- Betainhydrochlorid
- Englischer Name
- Betaine hydrochloride
- Summenformel
- C5H12ClNO2
- Molmasse
- 153.61
Namen und Synonyme
Betaine hydrochloride590-46-5Betaine chlorideBetaine HClAchylinBetainum muriaticum(Carboxymethyl)trimethylammonium chlorideAcidol pepsinDTXSID0044446NSC-3976JK8U8K4D6KNSC-32191
Weitere Namen anzeigen
acidolhydrochlorideBETAIN HYDROCHLORIDEAcinormLYCINE HYDROCHLORIDEAchyinEuacidMuriatAcidin
Hydrochloride, BetaineNSC3976Betaine hydrochloride (USP)Betaine hydrochloride [USP]DTXCID8024446NSC32191RefChem:567997209-683-1
Datenbank-Bezeichner
- CAS
590-46-5- PubChem CID
- 11545
- DTXSID
DTXSID0044446- ChEMBL
CHEMBL1201130- UNII
- JK8U8K4D6K
- EC Number
- 209-683-1
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 37,3 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 3
- Frei drehbare Bindungen
- 2
- Schwere Atome
- 9
- Formalladung
- 0
- Komplexität
- 93,1
Experimentelle und physikochemische Eigenschaften
Collision Cross Section122.5 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Physikochemische Eigenschaften
- Schmelzpunkt
- 241 · 241-242 °C(lit.)
- Dichte
- 1.29 · 1.29[at 20℃]
- Dampfdruck
- 0 Pa · 0Pa at 25℃
- FEMA
- 4223 · 4223 | BETAINE
- storage temp.
- room temp
- Löslichkeit
- 2 O: · H2O: 1 M at 20 °C, clear, colorless
- Aggregatzustand
- Powder or Crystals
- Farbe
- Colorless to white
- PH
- 1 · 1 (50g/l, H2O, 20℃)
- Biologische Quelle
- synthetic (organic)
- Wasserlöslichkeit
- 64.7 g/100 · 64.7 g/100 mL (25 ºC)
- Merck
- 14 · 14,1179
- BRN
- 3916181 · 3916181
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
This chemical does not meet GHS hazard criteria for 4.9% (8 of 164) of reports.
Danger
H318 (58.5%): Causes serious eye damage [Danger Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, P305+P354+P338, P317, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 164 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Gefahrenhinweise
Regulatory Information
Chemical: Methanaminium, 1-carboxy-N,N,N-trimethyl-, chloride
Regulation (EC) No 1831/2003 (amended)
REACH registered substance: Betaine hydrochloride (EC: 209-683-1)
Betain hydrochloride: Does not have an individual approval but may be used under an appropriate group standard
Hazard Classes and CategoriesEye Dam. 1 (58.5%)
Sicherheitsdaten
- F
- 3-10
- wgk
- 3
- tsca
- TSCA listed
- hs_code
- 29239000
- RTECS-Nr.
- BP3136000
- risk_code
- 36-36/37/38-20/21/22
- hazard_code
- Xi,Xn
- safety_code
- 26-39-24/25-36
- Speicherklasse
- 11 - Combustible Solids
- Hazard Classifications
- Eye Dam. 1
Chemie und Industrie
Pharmakologische Informationen
ATC Code
A - Alimentary tract and metabolism
QA - Alimentary tract and metabolism
MeSH Pharmacological Classification
Drugs used for their effects on the gastrointestinal system, as to control gastric acidity, regulate gastrointestinal motility and water flow, and improve digestion.
Endogenous factors or drugs that increase the transport and metabolism of LIPIDS including the synthesis of LIPOPROTEINS by the LIVER and their uptake by extrahepatic tissues.
Verwendung und Herstellung
General Manufacturing InformationMethanaminium, 1-carboxy-N,N,N-trimethyl-, chloride (1:1): ACTIVE
Anwendungen
BeschreibungBetaine hydrochloride is a vitamin-like substance that is a source of hydrochloric acid and aids the production of stomach acid. Gastric acid also helps protect the gastrointestinal tract from harmful bacteria. A normal level of gastric acid in the stomach—100,000-1,000,000 times more acidic than water—is sufficient to destroy bacteria, but some people produce deficient amounts of stomach acid, a condition that may lead to bacterial and parasitic infections of the intestines. One study showed that fasting people with normal gastric acid levels in the stomach had almost no bacteria in the small in- testine, while individuals with low levels of hydrochloric acid had some bacterial colonization in the stomach.Betaine hydrochloride is therefore recommended by some medical practitioners to sustain a healthy and normal production of stomach acid, especially to those that suffer from disorders such as allergies and asthma. Betaine hydrochloride is a synthesized chemical, and is not obtained from any plant or animal source. Gastric acid is produced by stomach cells, and is not available from any food source. Occasionally, betaine (C5H11NO2 )is recommended to reduce blood levels of homocysteine, which is associated with heart disease. This form of betaine is different from betaine hydrochlo- ride, and is available only with a doctor’s prescription.
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