Cyclopentadieneethanol
TL;DR: Cyclopentadieneethanol (CAS 66612-66-6) is a chemical compound with molecular formula C7H10O and molecular weight 110.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclopenta-1,3-dien-1-ylethanol
Also Known As: Cyclopentadieneethanol, 1,3-Cyclopentadiene-1-ethanol, 2-(cyclopenta-1,3-dienyl)ethanol, 2-cyclopenta-1,3-dien-1-ylethanol, 2-(1,3-Cyclopentadienyl)ethanol
| Molecular Formula | C7H10O |
|---|---|
| Molecular Weight | 110.07 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 110.073166 |
| Heavy Atoms | 8 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 66612-66-6 |
|---|---|
| SMILES | C1C=CC=C1CCO |
| InChIKey | MRILXPBRLYBPDT-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopentadieneethanol (CAS 66612-66-6), with molecular formula C7H10O and molecular weight 110.07 g/mol. IUPAC: 2-cyclopenta-1,3-dien-1-ylethanol.
Chemical Property Profile of Cyclopentadieneethanol
Property Insights of Cyclopentadieneethanol
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentadieneethanol. With a topological polar surface area (TPSA) of 20.2 Ų, Cyclopentadieneethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentadieneethanol has 1 hydrogen bond donor(s) and 1 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 Cyclopentadieneethanol?
The CAS number of Cyclopentadieneethanol is 66612-66-6.
What is the molecular formula of Cyclopentadieneethanol?
The molecular formula of Cyclopentadieneethanol is C7H10O.
What is the molecular weight of Cyclopentadieneethanol?
The molecular weight of Cyclopentadieneethanol is 110.07 g/mol.
Where can I buy Cyclopentadieneethanol?
You can request a quote for Cyclopentadieneethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentadieneethanol?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentadieneethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.