Caprylyl betaine
TL;DR: Caprylyl betaine (CAS 27593-14-2) is a chemical compound with molecular formula C12H25NO2 and molecular weight 215.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[dimethyl(octyl)azaniumyl]acetate
Also Known As: Caprylyl betaine, octylbetaine, Octyldimethylbetaine, n-octylbetaine, octyl betaine
| Molecular Formula | C12H25NO2 |
|---|---|
| Molecular Weight | 215.19 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 40.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 215.18852 |
| Heavy Atoms | 15 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 27593-14-2 |
|---|---|
| SMILES | CCCCCCCC[N+](C)(C)CC(=O)[O-] |
| InChIKey | YPUUGRMTUUCONZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Caprylyl betaine (CAS 27593-14-2), with molecular formula C12H25NO2 and molecular weight 215.19 g/mol. IUPAC: 2-[dimethyl(octyl)azaniumyl]acetate.
Chemical Property Profile of Caprylyl betaine
Property Insights of Caprylyl betaine
The XLogP value of 3.9 indicates that Caprylyl betaine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.1 Ų, Caprylyl betaine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Caprylyl betaine has 0 hydrogen bond donor(s) and 2 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 Caprylyl betaine?
The CAS number of Caprylyl betaine is 27593-14-2.
What is the molecular formula of Caprylyl betaine?
The molecular formula of Caprylyl betaine is C12H25NO2.
What is the molecular weight of Caprylyl betaine?
The molecular weight of Caprylyl betaine is 215.19 g/mol.
Where can I buy Caprylyl betaine?
You can request a quote for Caprylyl betaine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Caprylyl betaine?
Yes, KEHONG BIO provides custom synthesis services for Caprylyl betaine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.