Cyclohexyl formate
TL;DR: Cyclohexyl formate (CAS 4351-54-6) is a chemical compound with molecular formula C7H12O2 and molecular weight 128.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclohexyl formate
Also Known As: CYCLOHEXYL FORMATE, Formic acid, cyclohexyl ester, Cyclohexanol, formate, cyclohexyl ormate, FEMA No. 2353
| Molecular Formula | C7H12O2 |
|---|---|
| Molecular Weight | 128.08 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 128.08372 |
| Heavy Atoms | 9 |
| Complexity | 84.0 |
| Boiling Point | 162.00 to 163.00 °C. @ 760.00 mm Hg |
| Density | 1.052-1.060 |
| Solubility | insoluble in water; soluble in acetic and formic acid |
| Refractive Index | 1.439-1.445 |
Chemical Identifiers
| CAS Number | 4351-54-6 |
|---|---|
| SMILES | C1CCC(CC1)OC=O |
| InChIKey | VUXKVKAHWOVIDN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclohexyl formate (CAS 4351-54-6), with molecular formula C7H12O2 and molecular weight 128.08 g/mol. IUPAC: cyclohexyl formate.
Chemical Property Profile of Cyclohexyl formate
Property Insights of Cyclohexyl formate
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclohexyl formate. With a topological polar surface area (TPSA) of 26.3 Ų, Cyclohexyl formate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclohexyl formate has 0 hydrogen bond donor(s) and 2 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 Cyclohexyl formate?
The CAS number of Cyclohexyl formate is 4351-54-6.
What is the molecular formula of Cyclohexyl formate?
The molecular formula of Cyclohexyl formate is C7H12O2.
What is the molecular weight of Cyclohexyl formate?
The molecular weight of Cyclohexyl formate is 128.08 g/mol.
Where can I buy Cyclohexyl formate?
You can request a quote for Cyclohexyl formate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclohexyl formate?
Yes, KEHONG BIO provides custom synthesis services for Cyclohexyl formate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.