(Bicyclo(2.2.1)hept-2-yl)methyl benzoate
TL;DR: (Bicyclo(2.2.1)hept-2-yl)methyl benzoate (CAS 53075-50-6) is a chemical compound with molecular formula C15H18O2 and molecular weight 230.13068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-bicyclo[2.2.1]heptanylmethyl benzoate
Also Known As: Methylbenzoate, (Bicyclo(2.2.1)hept-2-yl)methyl benzoate, bicyclo[2.2.1]hept-2-ylmethylbenzoate, 3-bicyclo[2.2.1]heptanylmethyl benzoate, (BICYCLO[2.2.1]HEPT-2-YL)METHYL BENZOATE
Technical Specifications
| Molecular Formula | C15H18O2 |
| Molecular Weight | 230.13068 g/mol |
| XLogP | 4.1 |
| Topological Polar Surface Area (TPSA) | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 230.13068 Da |
| Heavy Atoms | 17 |
| Complexity | 281.0 |
| SMILES | C1CC2CC1CC2COC(=O)C3=CC=CC=C3 |
| InChIKey | UGGMYHIVEOWQOR-UHFFFAOYSA-N |
Chemical Property Profile of (Bicyclo(2.2.1)hept-2-yl)methyl benzoate
Property Insights of (Bicyclo(2.2.1)hept-2-yl)methyl benzoate
The XLogP value of 4.1 indicates that (Bicyclo(2.2.1)hept-2-yl)methyl benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.3 Ų, (Bicyclo(2.2.1)hept-2-yl)methyl benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (Bicyclo(2.2.1)hept-2-yl)methyl benzoate 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 (Bicyclo(2.2.1)hept-2-yl)methyl benzoate?
The CAS number of (Bicyclo(2.2.1)hept-2-yl)methyl benzoate is 53075-50-6.
What is the molecular formula of (Bicyclo(2.2.1)hept-2-yl)methyl benzoate?
The molecular formula of (Bicyclo(2.2.1)hept-2-yl)methyl benzoate is C15H18O2.
What is the molecular weight of (Bicyclo(2.2.1)hept-2-yl)methyl benzoate?
The molecular weight of (Bicyclo(2.2.1)hept-2-yl)methyl benzoate is 230.13068 g/mol.
Where can I buy (Bicyclo(2.2.1)hept-2-yl)methyl benzoate?
You can request a quote for (Bicyclo(2.2.1)hept-2-yl)methyl benzoate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (Bicyclo(2.2.1)hept-2-yl)methyl benzoate?
Yes, CoreyChem provides custom synthesis services for (Bicyclo(2.2.1)hept-2-yl)methyl benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.