1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate
TL;DR: 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate (CAS 67800-81-1) is a chemical compound with molecular formula C17H28O2 and molecular weight 264.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,6,6,8-tetramethyl-9-tricyclo[5.3.1.01,5]undecanyl) acetate
Also Known As: Cedrane-9-acetate, cedran-9-yl acetate, Octahydro-3,6,8,8-tetramethyl-1H-3a,7-methanoazulen-5-yl acetate, 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate, 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, acetate
| Molecular Formula | C17H28O2 |
|---|---|
| Molecular Weight | 264.21 g/mol |
| LogP | 4.9 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.20892 |
| Heavy Atoms | 19 |
| Complexity | 400.0 |
Chemical Identifiers
| CAS Number | 67800-81-1 |
|---|---|
| SMILES | CC1CCC2C13CC(C2(C)C)C(C(C3)OC(=O)C)C |
| InChIKey | DITDUMQEBPPYLV-UHFFFAOYSA-N |
Product Overview
1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate (CAS 67800-81-1), with molecular formula C17H28O2 and molecular weight 264.21 g/mol. IUPAC: (2,6,6,8-tetramethyl-9-tricyclo[5.3.1.01,5]undecanyl) acetate.
Chemical Property Profile of 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate
Property Insights of 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate
The XLogP value of 4.9 indicates that 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-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, 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-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 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate?
The CAS number of 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate is 67800-81-1.
What is the molecular formula of 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate?
The molecular formula of 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate is C17H28O2.
What is the molecular weight of 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate?
The molecular weight of 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate is 264.21 g/mol.
Where can I buy 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate?
You can request a quote for 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate?
Yes, KEHONG BIO provides custom synthesis services for 1H-3a,7-Methanoazulen-5-ol, octahydro-3,6,8,8-tetramethyl-, 5-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.