2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene
TL;DR: 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene (CAS 131320-81-5) is a chemical compound with molecular formula C11H16O3 and molecular weight 196.10994 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methyl acetate
Also Known As: 2-Amhmbh, 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene, [2-(hydroxymethyl)-3-bicyclo[2.2.1]hept-5-enyl]methyl acetate, Bicyclo[2.2.1]hept-5-ene-2,3-dimethanol,2-acetate, (1R,2S,3R,4S)-, [3-(hydroxymethyl)-2-bicyclo[2.2.1]hept-5-enyl]methyl acetate
Technical Specifications
| Molecular Formula | C11H16O3 |
| Molecular Weight | 196.10994 g/mol |
| XLogP | 1.0 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 196.10994 Da |
| Heavy Atoms | 14 |
| Complexity | 259.0 |
| SMILES | CC(=O)OCC1C2CC(C1CO)C=C2 |
| InChIKey | GRQPTGXDINMECF-UHFFFAOYSA-N |
Chemical Property Profile of 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene
Property Insights of 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene. With a topological polar surface area (TPSA) of 46.5 Ų, 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene 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
What is the CAS number of 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene?
The CAS number of 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene is 131320-81-5.
What is the molecular formula of 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene?
The molecular formula of 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene is C11H16O3.
What is the molecular weight of 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene?
The molecular weight of 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene is 196.10994 g/mol.
Where can I buy 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene?
You can request a quote for 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene?
Yes, CoreyChem provides custom synthesis services for 2-(Acetoxymethyl)-3-(hydroxymethyl)bicyclo-(2.2.1)-hept-5-ene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.