2-Hexylcyclopent-2-enyl acetate
TL;DR: 2-Hexylcyclopent-2-enyl acetate (CAS 56277-00-0) is a chemical compound with molecular formula C13H22O2 and molecular weight 210.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-hexylcyclopent-2-en-1-yl) acetate
Also Known As: 2-Hexylcyclopent-2-enyl acetate, 2-hexylcyclopent-2-enylacetate, 2-hexylcyclopent-2-en-1-yl acetate, (2-hexylcyclopent-2-en-1-yl) acetate, 2-Hexyl-2-cyclopenten-1-ol acetate
| Molecular Formula | C13H22O2 |
|---|---|
| Molecular Weight | 210.16 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 210.16199 |
| Heavy Atoms | 15 |
| Complexity | 231.0 |
Chemical Identifiers
| CAS Number | 56277-00-0 |
|---|---|
| SMILES | CCCCCCC1=CCCC1OC(=O)C |
| InChIKey | KGARLMJLKLKQMZ-UHFFFAOYSA-N |
Product Overview
2-Hexylcyclopent-2-enyl acetate (CAS 56277-00-0), with molecular formula C13H22O2 and molecular weight 210.16 g/mol. IUPAC: (2-hexylcyclopent-2-en-1-yl) acetate.
Chemical Property Profile of 2-Hexylcyclopent-2-enyl acetate
Property Insights of 2-Hexylcyclopent-2-enyl acetate
The XLogP value of 3.7 indicates that 2-Hexylcyclopent-2-enyl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, 2-Hexylcyclopent-2-enyl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Hexylcyclopent-2-enyl acetate 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 2-Hexylcyclopent-2-enyl acetate?
The CAS number of 2-Hexylcyclopent-2-enyl acetate is 56277-00-0.
What is the molecular formula of 2-Hexylcyclopent-2-enyl acetate?
The molecular formula of 2-Hexylcyclopent-2-enyl acetate is C13H22O2.
What is the molecular weight of 2-Hexylcyclopent-2-enyl acetate?
The molecular weight of 2-Hexylcyclopent-2-enyl acetate is 210.16 g/mol.
Where can I buy 2-Hexylcyclopent-2-enyl acetate?
You can request a quote for 2-Hexylcyclopent-2-enyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hexylcyclopent-2-enyl acetate?
Yes, KEHONG BIO provides custom synthesis services for 2-Hexylcyclopent-2-enyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.