Betaine chloride
TL;DR: Betaine chloride (CAS 590-46-5) is a chemical compound with molecular formula C5H12ClNO2 and molecular weight 153.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
carboxymethyl(trimethyl)azanium chloride
Also Known As: Betaine hydrochloride, Betaine chloride, Pluchine, Acipepsol, Cystadane
| Molecular Formula | C5H12ClNO2 |
|---|---|
| Molecular Weight | 153.06 g/mol |
| LogP | -3.22 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 153.05565 |
| Heavy Atoms | 9 |
| Complexity | 93.0 |
Chemical Identifiers
| CAS Number | 590-46-5 |
|---|---|
| SMILES | C[N+](C)(C)CC(=O)O.[Cl-] |
| InChIKey | HOPSCVCBEOCPJZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 21 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Betaine chloride (CAS 590-46-5), with molecular formula C5H12ClNO2 and molecular weight 153.06 g/mol. IUPAC: carboxymethyl(trimethyl)azanium chloride.
Chemical Property Profile of Betaine chloride
Property Insights of Betaine chloride
The XLogP value of -3.22 indicates that Betaine chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 37.3 Ų, Betaine chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Betaine chloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Betaine chloride?
The CAS number of Betaine chloride is 590-46-5.
What is the molecular formula of Betaine chloride?
The molecular formula of Betaine chloride is C5H12ClNO2.
What is the molecular weight of Betaine chloride?
The molecular weight of Betaine chloride is 153.06 g/mol.
Where can I buy Betaine chloride?
You can request a quote for Betaine chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Betaine chloride?
Yes, KEHONG BIO provides custom synthesis services for Betaine chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.