exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol
TL;DR: exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol (CAS 4488-58-8) is a chemical compound with molecular formula C16H22O and molecular weight 230.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phenol
Also Known As: p-isobornylphenol, 4-(1,7,7-trimethylbicyclo[2.2.1]hept-2-yl)phenol, 4-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phenol, 4-(4,7,7-trimethyl-3-bicyclo[2.2.1]heptanyl)phenol, exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol
| Molecular Formula | C16H22O |
|---|---|
| Molecular Weight | 230.17 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.16707 |
| Heavy Atoms | 17 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 4488-58-8 |
|---|---|
| SMILES | CC1(C2CCC1(C(C2)C3=CC=C(C=C3)O)C)C |
| InChIKey | DUDPYRGZUMHGFQ-UHFFFAOYSA-N |
Product Overview
exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol (CAS 4488-58-8), with molecular formula C16H22O and molecular weight 230.17 g/mol. IUPAC: 4-(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl)phenol.
Chemical Property Profile of exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol
Property Insights of exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol
The XLogP value of 4.9 indicates that exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol 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 exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol?
The CAS number of exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol is 4488-58-8.
What is the molecular formula of exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol?
The molecular formula of exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol is C16H22O.
What is the molecular weight of exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol?
The molecular weight of exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol is 230.17 g/mol.
Where can I buy exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol?
You can request a quote for exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol?
Yes, KEHONG BIO provides custom synthesis services for exo-p-(1,7,7-Trimethylbicyclo(2.2.1)hept-2-yl)phenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.