1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate
TL;DR: 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate (CAS 7462-24-0) is a chemical compound with molecular formula C17H22O3 and molecular weight 274.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl) 2-hydroxybenzoate
Also Known As: FENCHYL SALICYLATE, 1,3,3-trimethylbicyclo[2.2.1]hept-2-yl salicylate, 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate, 1,3,3-trimethylbicyclo[2.2.1]heptan-2-yl 2-hydroxybenzoate, (2,2,4-trimethyl-3-bicyclo[2.2.1]heptanyl) 2-hydroxybenzoate
| Molecular Formula | C17H22O3 |
|---|---|
| Molecular Weight | 274.16 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.1569 |
| Heavy Atoms | 20 |
| Complexity | 403.0 |
Chemical Identifiers
| CAS Number | 7462-24-0 |
|---|---|
| SMILES | CC1(C2CCC(C2)(C1OC(=O)C3=CC=CC=C3O)C)C |
| InChIKey | XQPZKMWBRDTOGK-UHFFFAOYSA-N |
Product Overview
1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate (CAS 7462-24-0), with molecular formula C17H22O3 and molecular weight 274.16 g/mol. IUPAC: (1,3,3-trimethyl-2-bicyclo[2.2.1]heptanyl) 2-hydroxybenzoate.
Chemical Property Profile of 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate
Property Insights of 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate
The XLogP value of 4.9 indicates that 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate has 1 hydrogen bond donor(s) and 3 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 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate?
The CAS number of 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate is 7462-24-0.
What is the molecular formula of 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate?
The molecular formula of 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate is C17H22O3.
What is the molecular weight of 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate?
The molecular weight of 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate is 274.16 g/mol.
Where can I buy 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate?
You can request a quote for 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate?
Yes, KEHONG BIO provides custom synthesis services for 1,3,3-Trimethylbicyclo(2.2.1)hept-2-yl salicylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.