Ethylcyclopentadiene
TL;DR: Ethylcyclopentadiene (CAS 617-88-9) is a chemical compound with molecular formula C7H10 and molecular weight 94.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-ethylcyclopenta-1,3-diene
Also Known As: ethylcyclopentadiene, ethylcylopentadiene, 2-chloromethylfuran, 1-Ethylcyclopentadiene, 1-ethylcyclopenta-1,3-diene
| Molecular Formula | C7H10 |
|---|---|
| Molecular Weight | 94.08 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 94.07825 |
| Heavy Atoms | 7 |
| Complexity | 107.0 |
Chemical Identifiers
| CAS Number | 617-88-9 |
|---|---|
| SMILES | CCC1=CC=CC1 |
| InChIKey | IQSUNBLELDRPEY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethylcyclopentadiene (CAS 617-88-9), with molecular formula C7H10 and molecular weight 94.08 g/mol. IUPAC: 1-ethylcyclopenta-1,3-diene.
Chemical Property Profile of Ethylcyclopentadiene
Property Insights of Ethylcyclopentadiene
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethylcyclopentadiene. With a topological polar surface area (TPSA) of 0.0 Ų, Ethylcyclopentadiene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethylcyclopentadiene has 0 hydrogen bond donor(s) and 0 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 Ethylcyclopentadiene?
The CAS number of Ethylcyclopentadiene is 617-88-9.
What is the molecular formula of Ethylcyclopentadiene?
The molecular formula of Ethylcyclopentadiene is C7H10.
What is the molecular weight of Ethylcyclopentadiene?
The molecular weight of Ethylcyclopentadiene is 94.08 g/mol.
Where can I buy Ethylcyclopentadiene?
You can request a quote for Ethylcyclopentadiene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethylcyclopentadiene?
Yes, KEHONG BIO provides custom synthesis services for Ethylcyclopentadiene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.