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Bicyclo[2.2.1]heptane-2-methanol, 2-acetate
TL;DR: Bicyclo[2.2.1]heptane-2-methanol, 2-acetate (CAS 53075-46-0) is a chemical compound with molecular formula C10H16O2 and molecular weight 168.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bicyclo[2.2.1]heptanylmethyl acetate
Also Known As: (bicyclo[2.2.1]hept-2-yl)methyl acetate, norbornan-2-ylmethyl acetate, bicyclo[2.2.1]heptan-2-ylmethyl acetate, {bicyclo[2.2.1]heptan-2-yl}methyl acetate, bicyclo[2.2.1]hept-2-ylmethylacetate
| Molecular Formula | C10H16O2 |
|---|---|
| Molecular Weight | 168.12 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 168.11504 |
| Heavy Atoms | 12 |
| Complexity | 188.0 |
Chemical Identifiers
| CAS Number | 53075-46-0 |
|---|---|
| SMILES | CC(=O)OCC1CC2CCC1C2 |
| InChIKey | PNHMYWBHPUEEDK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Bicyclo[2.2.1]heptane-2-methanol, 2-acetate (CAS 53075-46-0), with molecular formula C10H16O2 and molecular weight 168.12 g/mol. IUPAC: 2-bicyclo[2.2.1]heptanylmethyl acetate.
Chemical Property Profile of Bicyclo[2.2.1]heptane-2-methanol, 2-acetate
Property Insights of Bicyclo[2.2.1]heptane-2-methanol, 2-acetate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bicyclo[2.2.1]heptane-2-methanol, 2-acetate. With a topological polar surface area (TPSA) of 26.3 Ų, Bicyclo[2.2.1]heptane-2-methanol, 2-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Bicyclo[2.2.1]heptane-2-methanol, 2-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 Bicyclo[2.2.1]heptane-2-methanol, 2-acetate?
The CAS number of Bicyclo[2.2.1]heptane-2-methanol, 2-acetate is 53075-46-0.
What is the molecular formula of Bicyclo[2.2.1]heptane-2-methanol, 2-acetate?
The molecular formula of Bicyclo[2.2.1]heptane-2-methanol, 2-acetate is C10H16O2.
What is the molecular weight of Bicyclo[2.2.1]heptane-2-methanol, 2-acetate?
The molecular weight of Bicyclo[2.2.1]heptane-2-methanol, 2-acetate is 168.12 g/mol.
Where can I buy Bicyclo[2.2.1]heptane-2-methanol, 2-acetate?
You can request a quote for Bicyclo[2.2.1]heptane-2-methanol, 2-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bicyclo[2.2.1]heptane-2-methanol, 2-acetate?
Yes, KEHONG BIO provides custom synthesis services for Bicyclo[2.2.1]heptane-2-methanol, 2-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.