Heptyl cyclohexanecarboxylate
TL;DR: Heptyl cyclohexanecarboxylate (CAS 93132-85-5) is a chemical compound with molecular formula C14H26O2 and molecular weight 226.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
heptyl cyclohexanecarboxylate
Also Known As: Heptyl cyclohexanecarboxylate, heptylcyclohexanecarboxylate, Cyclohexanecarboxylic acid, heptyl ester, Cyclohexanecarboxylic acid heptyl ester, EINECS 296-132-3
| Molecular Formula | C14H26O2 |
|---|---|
| Molecular Weight | 226.19 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 8 |
| Exact Mass | 226.19328 |
| Heavy Atoms | 16 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 93132-85-5 |
|---|---|
| SMILES | CCCCCCCOC(=O)C1CCCCC1 |
| InChIKey | NUUQQOTYKFJRDX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptyl cyclohexanecarboxylate (CAS 93132-85-5), with molecular formula C14H26O2 and molecular weight 226.19 g/mol. IUPAC: heptyl cyclohexanecarboxylate.
Chemical Property Profile of Heptyl cyclohexanecarboxylate
Property Insights of Heptyl cyclohexanecarboxylate
The XLogP value of 5.1 indicates that Heptyl cyclohexanecarboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Heptyl cyclohexanecarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptyl cyclohexanecarboxylate has 0 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 Heptyl cyclohexanecarboxylate?
The CAS number of Heptyl cyclohexanecarboxylate is 93132-85-5.
What is the molecular formula of Heptyl cyclohexanecarboxylate?
The molecular formula of Heptyl cyclohexanecarboxylate is C14H26O2.
What is the molecular weight of Heptyl cyclohexanecarboxylate?
The molecular weight of Heptyl cyclohexanecarboxylate is 226.19 g/mol.
Where can I buy Heptyl cyclohexanecarboxylate?
You can request a quote for Heptyl cyclohexanecarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptyl cyclohexanecarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Heptyl cyclohexanecarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.