Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester
TL;DR: Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester (CAS 92618-89-8) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.14633 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl) acetate
Also Known As: BORNYL ACETATE, Isobornyl acetate, Borneol, acetate, (+)-Bornyl acetate, Pichtosin
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H20O2 |
| Molecular Weight | 196.14633 g/mol |
| XLogP | 3.3 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.14633 Da |
| Heavy Atoms | 14 |
| Complexity | 269.0 |
| Density | 0.981-0.985 |
| Refractive Index | 1.462-1.466 |
| Solubility | Slightly soluble in water; Insoluble in glycerin, propylene glycol |
| SMILES | CC(=O)OC1CC2CCC1(C2(C)C)C |
| InChIKey | KGEKLUUHTZCSIP-UHFFFAOYSA-N |
Product Description
Applications: Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester is used in surfactant and detergent formulations, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester (CAS 92618-89-8) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester is a surfactant raw material identified by CAS number 92618-89-8 and the molecular formula C12H20O2 and a molecular weight of 196.15 g/mol. Physically, the compound has a density of 0.981-0.985 g/cm³, a solubility: Slightly soluble in water; Insoluble in glycerin, propylene glycol. It is also known as BORNYL ACETATE and Isobornyl acetate.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester
Property Insights of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester
The XLogP value of 3.3 indicates that Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester?
The CAS number of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester is 92618-89-8.
What is the molecular formula of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester?
The molecular formula of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester is C12H20O2.
What is the molecular weight of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester?
The molecular weight of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester is 196.14633 g/mol.
What are the applications of Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester?
Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester is used in surfactant and detergent formulations, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Acetic acid...
Where can I buy Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester?
You can request a quote for Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester?
Yes, CoreyChem provides custom synthesis services for Acetic acid 1,7,7-trimethyl-bicyclo(2.2.1)hept-2-yl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.