6-exo-Isocamphanyl-3,4-xylenol
TL;DR: 6-exo-Isocamphanyl-3,4-xylenol (CAS 39259-32-0) is a chemical compound with molecular formula C18H26O and molecular weight 258.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dimethyl-2-(5,5,6-trimethyl-2-bicyclo[2.2.1]heptanyl)phenol
Also Known As: 6-exo-Isocamphanyl-3,4-xylenol, (exo,exo)-4,5-Dimethyl-2-(5,5,6-trimethylbicyclo(2.2.1)hept-2-yl)phenol, 4,5-dimethyl-2-(5,5,6-trimethylbicyclo[2.2.1]hept-2-yl)phenol, Phenol, 4,5-dimethyl-2-(5,5,6-trimethylbicyclo(2.2.1)hept-2-yl)-, (exo,exo)-, 4,5-dimethyl-2-(2,2,3-trimethyl-5-bicyclo[2.2.1]heptanyl)phenol
| Molecular Formula | C18H26O |
|---|---|
| Molecular Weight | 258.20 g/mol |
| LogP | 5.5 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 258.19836 |
| Heavy Atoms | 19 |
| Complexity | 348.0 |
Chemical Identifiers
| CAS Number | 39259-32-0 |
|---|---|
| SMILES | CC1C2CC(C1(C)C)CC2C3=C(C=C(C(=C3)C)C)O |
| InChIKey | QVKROXHNVAKLSP-UHFFFAOYSA-N |
Product Overview
6-exo-Isocamphanyl-3,4-xylenol (CAS 39259-32-0), with molecular formula C18H26O and molecular weight 258.20 g/mol. IUPAC: 4,5-dimethyl-2-(5,5,6-trimethyl-2-bicyclo[2.2.1]heptanyl)phenol.
Chemical Property Profile of 6-exo-Isocamphanyl-3,4-xylenol
Property Insights of 6-exo-Isocamphanyl-3,4-xylenol
The XLogP value of 5.5 indicates that 6-exo-Isocamphanyl-3,4-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-exo-Isocamphanyl-3,4-xylenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-exo-Isocamphanyl-3,4-xylenol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-exo-Isocamphanyl-3,4-xylenol?
The CAS number of 6-exo-Isocamphanyl-3,4-xylenol is 39259-32-0.
What is the molecular formula of 6-exo-Isocamphanyl-3,4-xylenol?
The molecular formula of 6-exo-Isocamphanyl-3,4-xylenol is C18H26O.
What is the molecular weight of 6-exo-Isocamphanyl-3,4-xylenol?
The molecular weight of 6-exo-Isocamphanyl-3,4-xylenol is 258.20 g/mol.
Where can I buy 6-exo-Isocamphanyl-3,4-xylenol?
You can request a quote for 6-exo-Isocamphanyl-3,4-xylenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-exo-Isocamphanyl-3,4-xylenol?
Yes, KEHONG BIO provides custom synthesis services for 6-exo-Isocamphanyl-3,4-xylenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.