2-己基辛酸
TL;DR: 2-己基辛酸 (CAS 60948-91-6) is a chemical compound with molecular formula C14H28O2 and molecular weight 228.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-己基辛酸
2-hexyloctanoic acid
Also Known As: 2-Hexyloctanoic acid, 2-Hexyloctanoicacid, Octanoic acid, 2-hexyl-, 2-hexyl-octanoic acid, H-Tyr(Bzl)-OMe.HCl
| Molecular Formula | C14H28O2 |
|---|---|
| Molecular Weight | 228.21 g/mol |
| LogP | 5.4 |
| Topological Polar Surface Area | 37.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 11 |
| Exact Mass | 228.20892 |
| Heavy Atoms | 16 |
| Complexity | 154.0 |
Chemical Identifiers
| CAS Number | 60948-91-6 |
|---|---|
| SMILES | CCCCCCC(CCCCCC)C(=O)O |
| InChIKey | SQPZLZZLAPHSPL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-己基辛酸 (CAS 60948-91-6), with molecular formula C14H28O2 and molecular weight 228.21 g/mol. IUPAC: 2-hexyloctanoic acid.
Chemical Property Profile of 2-己基辛酸
Property Insights of 2-己基辛酸
The XLogP value of 5.4 indicates that 2-己基辛酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.3 Ų, 2-己基辛酸 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-己基辛酸 has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-己基辛酸?
The CAS number of 2-己基辛酸 is 60948-91-6.
What is the molecular formula of 2-己基辛酸?
The molecular formula of 2-己基辛酸 is C14H28O2.
What is the molecular weight of 2-己基辛酸?
The molecular weight of 2-己基辛酸 is 228.21 g/mol.
Where can I buy 2-己基辛酸?
You can request a quote for 2-己基辛酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-己基辛酸?
Yes, KEHONG BIO provides custom synthesis services for 2-己基辛酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.