2(或3)-羧基-4-己基环己烷辛酸
TL;DR: 2(或3)-羧基-4-己基环己烷辛酸 (CAS 67816-12-0) is a chemical compound with molecular formula C21H38O4 and molecular weight 354.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2(或3)-羧基-4-己基环己烷辛酸
2-(1-cyclohexylundecan-5-yl)butanedioic acid
Also Known As: 2-(1-cyclohexylundecan-5-yl)butanedioic acid, 2(Or 3)-carboxy-4-hexylcyclohexaneoctanoic acid, 5(6)-Carboxy-4-hexylcyclohexane-1-octanoic acid, Cyclohexaneoctanoic acid, 2(or 3)-carboxy-4-hexyl-, EINECS 267-215-1
| Molecular Formula | C21H38O4 |
|---|---|
| Molecular Weight | 354.28 g/mol |
| LogP | 7.7 |
| Topological Polar Surface Area | 74.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 14 |
| Exact Mass | 354.277 |
| Heavy Atoms | 25 |
| Complexity | 374.0 |
Chemical Identifiers
| CAS Number | 67816-12-0 |
|---|---|
| SMILES | CCCCCCC(CCCCC1CCCCC1)C(CC(=O)O)C(=O)O |
| InChIKey | WYMULJWSHAGNEH-UHFFFAOYSA-N |
Product Overview
2(或3)-羧基-4-己基环己烷辛酸 (CAS 67816-12-0), with molecular formula C21H38O4 and molecular weight 354.28 g/mol. IUPAC: 2-(1-cyclohexylundecan-5-yl)butanedioic acid.
Chemical Property Profile of 2(或3)-羧基-4-己基环己烷辛酸
Property Insights of 2(或3)-羧基-4-己基环己烷辛酸
The XLogP value of 7.7 indicates that 2(或3)-羧基-4-己基环己烷辛酸 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2(或3)-羧基-4-己基环己烷辛酸. Following Lipinski's Rule of Five, 2(或3)-羧基-4-己基环己烷辛酸 has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2(或3)-羧基-4-己基环己烷辛酸?
The CAS number of 2(或3)-羧基-4-己基环己烷辛酸 is 67816-12-0.
What is the molecular formula of 2(或3)-羧基-4-己基环己烷辛酸?
The molecular formula of 2(或3)-羧基-4-己基环己烷辛酸 is C21H38O4.
What is the molecular weight of 2(或3)-羧基-4-己基环己烷辛酸?
The molecular weight of 2(或3)-羧基-4-己基环己烷辛酸 is 354.28 g/mol.
Where can I buy 2(或3)-羧基-4-己基环己烷辛酸?
You can request a quote for 2(或3)-羧基-4-己基环己烷辛酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2(或3)-羧基-4-己基环己烷辛酸?
Yes, KEHONG BIO provides custom synthesis services for 2(或3)-羧基-4-己基环己烷辛酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.