![2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid structure](/static/products/121/1212463-28-9.webp)
2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid
TL;DR: 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid (CAS 1212463-28-9) is a chemical compound with molecular formula C18H22O4 and molecular weight 302.1518 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[(1,5,5-trimethyl-2-bicyclo[2.2.1]heptanyl)oxycarbonyl]benzoic acid
Also Known As: 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid, 2-[(1,5,5-trimethyl-2-bicyclo[2.2.1]heptyl)oxycarbonyl]benzoic Acid, 2-[(2,2,4-trimethyl-5-bicyclo[2.2.1]heptanyl)oxycarbonyl]benzoic acid, 2-{[(1,5,5-trimethylbicyclo[2.2.1]hept-2-yl)oxy]carbonyl}benzoic acid
Technical Specifications
| Molecular Formula | C18H22O4 |
| Molecular Weight | 302.1518 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 302.1518 Da |
| Heavy Atoms | 22 |
| Complexity | 483.0 |
| SMILES | CC1(CC2(CC1CC2OC(=O)C3=CC=CC=C3C(=O)O)C)C |
| InChIKey | ZSKLSZZSGZABIR-UHFFFAOYSA-N |
Chemical Property Profile of 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid
Property Insights of 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid
The XLogP value of 4.1 indicates that 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid. Following Lipinski's Rule of Five, 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid?
The CAS number of 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid is 1212463-28-9.
What is the molecular formula of 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid?
The molecular formula of 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid is C18H22O4.
What is the molecular weight of 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid?
The molecular weight of 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid is 302.1518 g/mol.
Where can I buy 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid?
You can request a quote for 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid?
Yes, CoreyChem provides custom synthesis services for 2-((((1S,2R,4S)-1,5,5-trimethylbicyclo[2.2.1]heptan-2-yl)oxy)carbonyl)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.