Cyclopentadienylcarbinol
TL;DR: Cyclopentadienylcarbinol (CAS 13029-74-8) is a chemical compound with molecular formula C6H8O and molecular weight 96.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cyclopenta-2,4-dien-1-ylmethanol
Also Known As: cyclopentadienylcarbinol, 2,4-Cyclopentadienylmethanol, cyclopenta-2,4-dien-1-ylmethanol, (2,4-Cyclopentadienyl)methanol, 1,3-Cyclopentadiene-5-methanol
| Molecular Formula | C6H8O |
|---|---|
| Molecular Weight | 96.06 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 96.05752 |
| Heavy Atoms | 7 |
| Complexity | 90.0 |
Chemical Identifiers
| CAS Number | 13029-74-8 |
|---|---|
| SMILES | C1=CC(C=C1)CO |
| InChIKey | YPYFWQGTUZSRIA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Cyclopentadienylcarbinol (CAS 13029-74-8), with molecular formula C6H8O and molecular weight 96.06 g/mol. IUPAC: cyclopenta-2,4-dien-1-ylmethanol.
Chemical Property Profile of Cyclopentadienylcarbinol
Property Insights of Cyclopentadienylcarbinol
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Cyclopentadienylcarbinol. With a topological polar surface area (TPSA) of 20.2 Ų, Cyclopentadienylcarbinol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentadienylcarbinol 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 Cyclopentadienylcarbinol?
The CAS number of Cyclopentadienylcarbinol is 13029-74-8.
What is the molecular formula of Cyclopentadienylcarbinol?
The molecular formula of Cyclopentadienylcarbinol is C6H8O.
What is the molecular weight of Cyclopentadienylcarbinol?
The molecular weight of Cyclopentadienylcarbinol is 96.06 g/mol.
Where can I buy Cyclopentadienylcarbinol?
You can request a quote for Cyclopentadienylcarbinol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Cyclopentadienylcarbinol?
Yes, KEHONG BIO provides custom synthesis services for Cyclopentadienylcarbinol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.