6-Cyclopentyl-2,4-xylenol
TL;DR: 6-Cyclopentyl-2,4-xylenol (CAS 52479-94-4) is a chemical compound with molecular formula C13H18O and molecular weight 190.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-cyclopentyl-4,6-dimethylphenol
Also Known As: 6-Cyclopentyl-2,4-xylenol, 2-cyclopentyl-4,6-dimethylphenol, Phenol,2-cyclopentyl-4,6-dimethyl-, EINECS 257-946-4
| Molecular Formula | C13H18O |
|---|---|
| Molecular Weight | 190.14 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 190.13577 |
| Heavy Atoms | 14 |
| Complexity | 184.0 |
Chemical Identifiers
| CAS Number | 52479-94-4 |
|---|---|
| SMILES | CC1=CC(=C(C(=C1)C2CCCC2)O)C |
| InChIKey | VRNMLRLXNNNMIN-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Cyclopentyl-2,4-xylenol (CAS 52479-94-4), with molecular formula C13H18O and molecular weight 190.14 g/mol. IUPAC: 2-cyclopentyl-4,6-dimethylphenol.
Chemical Property Profile of 6-Cyclopentyl-2,4-xylenol
Property Insights of 6-Cyclopentyl-2,4-xylenol
The XLogP value of 4.3 indicates that 6-Cyclopentyl-2,4-xylenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 6-Cyclopentyl-2,4-xylenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Cyclopentyl-2,4-xylenol 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 6-Cyclopentyl-2,4-xylenol?
The CAS number of 6-Cyclopentyl-2,4-xylenol is 52479-94-4.
What is the molecular formula of 6-Cyclopentyl-2,4-xylenol?
The molecular formula of 6-Cyclopentyl-2,4-xylenol is C13H18O.
What is the molecular weight of 6-Cyclopentyl-2,4-xylenol?
The molecular weight of 6-Cyclopentyl-2,4-xylenol is 190.14 g/mol.
Where can I buy 6-Cyclopentyl-2,4-xylenol?
You can request a quote for 6-Cyclopentyl-2,4-xylenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Cyclopentyl-2,4-xylenol?
Yes, KEHONG BIO provides custom synthesis services for 6-Cyclopentyl-2,4-xylenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.