Bornyl acetate, (-)-
TL;DR: Bornyl acetate, (-)- (CAS 5655-61-8) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] acetate
Also Known As: (-)-Bornyl acetate, BORNYL ACETATE, L-bornyl acetate, borneol acetate, Bornylacetate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 269.0 |
| Density | 0.981-0.985 |
| Solubility | Slightly soluble in water; Insoluble in glycerin, propylene glycol |
| Vapor Pressure | 0.6 [mmHg] |
| Refractive Index | 1.462-1.466 |
Chemical Identifiers
| CAS Number | 5655-61-8 |
|---|---|
| SMILES | CC(=O)O[C@@H]1C[C@@H]2CC[C@]1(C2(C)C)C |
| InChIKey | KGEKLUUHTZCSIP-HOSYDEDBSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bornyl acetate, (-)- (CAS 5655-61-8), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: [(1S,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl] acetate.
Chemical Property Profile of Bornyl acetate, (-)-
Property Insights of Bornyl acetate, (-)-
The XLogP value of 3.3 indicates that Bornyl acetate, (-)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, Bornyl acetate, (-)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bornyl acetate, (-)- 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
Frequently Asked Questions
What is the CAS number of Bornyl acetate, (-)-?
The CAS number of Bornyl acetate, (-)- is 5655-61-8.
What is the molecular formula of Bornyl acetate, (-)-?
The molecular formula of Bornyl acetate, (-)- is C12H20O2.
What is the molecular weight of Bornyl acetate, (-)-?
The molecular weight of Bornyl acetate, (-)- is 196.15 g/mol.
Where can I buy Bornyl acetate, (-)-?
You can request a quote for Bornyl acetate, (-)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bornyl acetate, (-)-?
Yes, KEHONG BIO provides custom synthesis services for Bornyl acetate, (-)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.