Choline bitartrate - ≥98%, contains silicon dioxide as stabilizer , CAS No.87-67-2

CAS: 87-67-2 Cat. No.: C113873 Formula: C₉H₁₉NO₇ Peso molecolare: 253.25 Numero EC: 201-763-4

GRADE & PURITY ≥98%, contains silicon dioxide as stabilizer

Synonyms

2-hydroxyethyl(trimethyl)azanium;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate | 2-hydroxyethyl(trimethyl)azanium;2,3,4-trihydroxy-4-oxobutanoate | BCP23009 | 2-Hydroxy-N,N,N-trimethylethanaminium 3-carboxy-2,3-dihydroxypropanoate | Choline tartrate (1:1) | CHO

Storage

Argon charged,Room temperature

Shipped In

Normal

Panoramica

Acyl group acceptor ,Choline acetyltransferase substrate

Specifications

Sinonimi

2-hydroxyethyl(trimethyl)azanium;(2R,3R)-2,3,4-trihydroxy-4-oxobutanoate | 2-hydroxyethyl(trimethyl)azanium;2,3,4-trihydroxy-4-oxobutanoate | BCP23009 | 2-Hydroxy-N,N,N-trimethylethanaminium 3-carboxy-2,3-dihydroxypropanoate | Choline tartrate (1:1) | CHO

Specifiche e purezza

≥98%, contains silicon dioxide as stabilizer

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Purezza

≥98%

Nomi e identificatori

• Pubchem Sid: 504765322
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504765322
• Sorrisi canonici: C[N+](C)(C)CCO.C(C(C(=O)[O-])O)(C(=O)O)O
• IUPAC Name: 2-hydroxyethyl(trimethyl)azanium;2,3,4-trihydroxy-4-oxobutanoate
• InChIKey: QWJSAWXRUVVRLH-UHFFFAOYSA-M
• INCHI: 1S/C5H14NO.C4H6O6/c1-6(2,3)4-5-7;5-1(3(7)8)2(6)4(9)10/h7H,4-5H2,1-3H3;1-2,5-6H,(H,7,8)(H,9,10)/q+1;/p-1
• Isomeri SMILES: C[N+](C)(C)CCO.C(C(C(=O)[O-])O)(C(=O)O)O
• WGK Germania: 3
• Peso molecolare: 253.25
• Reaxy-Rn: 4064889
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=4064889&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Classe Organonitrogen compounds
      • Subclass Quaternary ammonium salts

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Classe: Organonitrogen compounds
• Subclass: Quaternary ammonium salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Cholines
• Alternative Parents: Dicarboxylic acids and derivatives Tetraalkylammonium salts 1,2-aminoalcohols Primary alcohols Organopnictogen compounds Organic salts Hydrocarbon derivatives
• Molecular Framework: Not available
• Substituents: Choline - Dicarboxylic acid or derivatives - Tetraalkylammonium salt - 1,2-aminoalcohol - Alkanolamine - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organic salt - Primary alcohol - Organooxygen compound - Amine - Alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as cholines. These are organic compounds containing a N,N,N-trimethylethanolammonium cation.
• External Descriptors: Not available

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Proprietà chimiche e fisiche

• Sensibilità: Moisture sensitive
• Rotazione specifica [α]: 17° (C=10,H2O)
• Punto di fusione (°C): 150 °C
• Peso molecolare: 253.250 g/mol
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 253.116 Da
• Monoisotopic Mass: 253.116 Da
• Topological Polar Surface Area: 138.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 193.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 2
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 2

XLogP3

Riferimenti

1. Xianqi Wang, Jie Wang, Beibei Hu, Yuyue Zhang, Hongzhe Tian.  (2024)  Rapid determination of organophosphorus insecticides residue in fruit juice by a fluorescence sensor based on carbon quantum dots.  JOURNAL OF FOOD COMPOSITION AND ANALYSIS,      [PMID:] [10.1016/j.jfca.2024.106816]

2. Yuyue Zhang, Beibei Hu, Xianqi Wang, Hongzhe Tian.  (2025)  Synthesis and Characterization of N-Doped Carbon Quantum Dots and Its Toxic Effects on Chlorella vulgaris.  ChemistrySelect,  10  (25): (e01361).  [PMID:] [10.1002/slct.202501361]

Domande frequenti

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 87-67-2, the molecular formula is C9H19NO7, and the molecular weight is 253.25 g/mol. InChIKey QWJSAWXRUVVRLH-UHFFFAOYSA-M.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.