2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate
TL;DR: 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate (CAS 30574-44-8) is a chemical compound with molecular formula C12H20O2 and molecular weight 196.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethylocta-2,7-dienyl acetate
Also Known As: 2,6-Dimethylocta-2,7-dienyl acetate, 2,6-Dimethylocta-2,7-dienylacetate, 2,7-Octadien-1-ol, 2,6-dimethyl-, acetate, 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate, 2,7-Octadien-1-ol,2,6-dimethyl-, 1-acetate
| Molecular Formula | C12H20O2 |
|---|---|
| Molecular Weight | 196.15 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 196.14633 |
| Heavy Atoms | 14 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 30574-44-8 |
|---|---|
| SMILES | CC(CCC=C(C)COC(=O)C)C=C |
| InChIKey | KHXMGJZMOXCCNP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate (CAS 30574-44-8), with molecular formula C12H20O2 and molecular weight 196.15 g/mol. IUPAC: 2,6-dimethylocta-2,7-dienyl acetate.
Chemical Property Profile of 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate
Property Insights of 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate
The XLogP value of 3.5 indicates that 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-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, 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-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 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate?
The CAS number of 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate is 30574-44-8.
What is the molecular formula of 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate?
The molecular formula of 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate is C12H20O2.
What is the molecular weight of 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate?
The molecular weight of 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate is 196.15 g/mol.
Where can I buy 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate?
You can request a quote for 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate?
Yes, KEHONG BIO provides custom synthesis services for 2,7-Octadien-1-ol, 2,6-dimethyl-, 1-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.