n-Butyl 2-hydroxy hexanoate
TL;DR: n-Butyl 2-hydroxy hexanoate (CAS 132513-53-2) is a chemical compound with molecular formula C10H20O3 and molecular weight 188.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
butyl 2-hydroxyhexanoate
Also Known As: Butyl 2-hydroxyhexanoate, n-butyl 2-hydroxy hexanoate, Hexanoic acid, 2-hydroxy-, butyl ester, (2S)-
| Molecular Formula | C10H20O3 |
|---|---|
| Molecular Weight | 188.14 g/mol |
| LogP | 1.8808 |
| Topological Polar Surface Area | 46.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 188.14125 |
| Heavy Atoms | 13 |
| Complexity | 134.13155 |
Chemical Identifiers
| CAS Number | 132513-53-2 |
|---|---|
| SMILES | CCCCC(C(=O)OCCCC)O |
Product Overview
n-Butyl 2-hydroxy hexanoate (CAS 132513-53-2), with molecular formula C10H20O3 and molecular weight 188.14 g/mol. IUPAC: butyl 2-hydroxyhexanoate.
Chemical Property Profile of n-Butyl 2-hydroxy hexanoate
Property Insights of n-Butyl 2-hydroxy hexanoate
The XLogP value of 1.8808 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Butyl 2-hydroxy hexanoate. With a topological polar surface area (TPSA) of 46.53 Ų, n-Butyl 2-hydroxy hexanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl 2-hydroxy hexanoate 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 n-Butyl 2-hydroxy hexanoate?
The CAS number of n-Butyl 2-hydroxy hexanoate is 132513-53-2.
What is the molecular formula of n-Butyl 2-hydroxy hexanoate?
The molecular formula of n-Butyl 2-hydroxy hexanoate is C10H20O3.
What is the molecular weight of n-Butyl 2-hydroxy hexanoate?
The molecular weight of n-Butyl 2-hydroxy hexanoate is 188.14 g/mol.
Where can I buy n-Butyl 2-hydroxy hexanoate?
You can request a quote for n-Butyl 2-hydroxy hexanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for n-Butyl 2-hydroxy hexanoate?
Yes, KEHONG BIO provides custom synthesis services for n-Butyl 2-hydroxy hexanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.