2-Caproylglycerol
TL;DR: 2-Caproylglycerol (CAS 70916-55-1) is a chemical compound with molecular formula C9H18O4 and molecular weight 190.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dihydroxypropan-2-yl hexanoate
Also Known As: beta-Monocaproin, 2-caproylglycerol, 1,3-dihydroxypropan-2-yl Hexanoate, 2-hexanoyloxy-propane-1,3-diol, Hexanoic acid 2-hydroxy-1-(hydroxymethyl)ethyl ester
| Molecular Formula | C9H18O4 |
|---|---|
| Molecular Weight | 190.12 g/mol |
| LogP | 0.4631 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 190.12051 |
| Heavy Atoms | 13 |
| Complexity | 131.57639 |
Chemical Identifiers
| CAS Number | 70916-55-1 |
|---|---|
| SMILES | CCCCCC(=O)OC(CO)CO |
Product Overview
2-Caproylglycerol (CAS 70916-55-1), with molecular formula C9H18O4 and molecular weight 190.12 g/mol. IUPAC: 1,3-dihydroxypropan-2-yl hexanoate.
Chemical Property Profile of 2-Caproylglycerol
Property Insights of 2-Caproylglycerol
The XLogP value of 0.4631 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Caproylglycerol. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Caproylglycerol. Following Lipinski's Rule of Five, 2-Caproylglycerol has 2 hydrogen bond donor(s) and 4 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 2-Caproylglycerol?
The CAS number of 2-Caproylglycerol is 70916-55-1.
What is the molecular formula of 2-Caproylglycerol?
The molecular formula of 2-Caproylglycerol is C9H18O4.
What is the molecular weight of 2-Caproylglycerol?
The molecular weight of 2-Caproylglycerol is 190.12 g/mol.
Where can I buy 2-Caproylglycerol?
You can request a quote for 2-Caproylglycerol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Caproylglycerol?
Yes, KEHONG BIO provides custom synthesis services for 2-Caproylglycerol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.