Lactic acid, acetate, hexyl ester
TL;DR: Lactic acid, acetate, hexyl ester (CAS 77008-66-3) is a chemical compound with molecular formula C11H20O4 and molecular weight 216.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
hexyl 2-acetyloxypropanoate
Also Known As: Hexyl 2-acetoxypropanoate, hexyl 2-acetyloxypropanoate, Lactic acid, acetate, hexyl ester, NIOSH/OD5450000, Lactic acid, hexyl ester, acetate
| Molecular Formula | C11H20O4 |
|---|---|
| Molecular Weight | 216.14 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 216.13615 |
| Heavy Atoms | 15 |
| Complexity | 201.0 |
Chemical Identifiers
| CAS Number | 77008-66-3 |
|---|---|
| SMILES | CCCCCCOC(=O)C(C)OC(=O)C |
| InChIKey | KWFBVRNLVSVNRP-UHFFFAOYSA-N |
Product Overview
Lactic acid, acetate, hexyl ester (CAS 77008-66-3), with molecular formula C11H20O4 and molecular weight 216.14 g/mol. IUPAC: hexyl 2-acetyloxypropanoate.
Chemical Property Profile of Lactic acid, acetate, hexyl ester
Property Insights of Lactic acid, acetate, hexyl ester
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lactic acid, acetate, hexyl ester. With a topological polar surface area (TPSA) of 52.6 Ų, Lactic acid, acetate, hexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lactic acid, acetate, hexyl ester has 0 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 Lactic acid, acetate, hexyl ester?
The CAS number of Lactic acid, acetate, hexyl ester is 77008-66-3.
What is the molecular formula of Lactic acid, acetate, hexyl ester?
The molecular formula of Lactic acid, acetate, hexyl ester is C11H20O4.
What is the molecular weight of Lactic acid, acetate, hexyl ester?
The molecular weight of Lactic acid, acetate, hexyl ester is 216.14 g/mol.
Where can I buy Lactic acid, acetate, hexyl ester?
You can request a quote for Lactic acid, acetate, hexyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lactic acid, acetate, hexyl ester?
Yes, KEHONG BIO provides custom synthesis services for Lactic acid, acetate, hexyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.