2,6-Dimethyl-7-octyne-2,6-diol
TL;DR: 2,6-Dimethyl-7-octyne-2,6-diol (CAS 29210-76-2) is a chemical compound with molecular formula C10H18O2 and molecular weight 170.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,6-dimethyloct-7-yne-2,6-diol
Also Known As: 2,6-Dimethyloct-7-yne-2,6-diol, 2,6-Dimethyl-7-octyne-2,6-diol, 7-Octyne-2,6-diol,2,6-dimethyl-, 7-Octyne-2,6-diol, 2,6-dimethyl-, 249-510-7
| Molecular Formula | C10H18O2 |
|---|---|
| Molecular Weight | 170.13 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 170.13068 |
| Heavy Atoms | 12 |
| Complexity | 187.0 |
Chemical Identifiers
| CAS Number | 29210-76-2 |
|---|---|
| SMILES | CC(C)(CCCC(C)(C#C)O)O |
| InChIKey | JJRIKWAHJMMDSF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,6-Dimethyl-7-octyne-2,6-diol (CAS 29210-76-2), with molecular formula C10H18O2 and molecular weight 170.13 g/mol. IUPAC: 2,6-dimethyloct-7-yne-2,6-diol.
Chemical Property Profile of 2,6-Dimethyl-7-octyne-2,6-diol
Property Insights of 2,6-Dimethyl-7-octyne-2,6-diol
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,6-Dimethyl-7-octyne-2,6-diol. With a topological polar surface area (TPSA) of 40.5 Ų, 2,6-Dimethyl-7-octyne-2,6-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethyl-7-octyne-2,6-diol has 2 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 2,6-Dimethyl-7-octyne-2,6-diol?
The CAS number of 2,6-Dimethyl-7-octyne-2,6-diol is 29210-76-2.
What is the molecular formula of 2,6-Dimethyl-7-octyne-2,6-diol?
The molecular formula of 2,6-Dimethyl-7-octyne-2,6-diol is C10H18O2.
What is the molecular weight of 2,6-Dimethyl-7-octyne-2,6-diol?
The molecular weight of 2,6-Dimethyl-7-octyne-2,6-diol is 170.13 g/mol.
Where can I buy 2,6-Dimethyl-7-octyne-2,6-diol?
You can request a quote for 2,6-Dimethyl-7-octyne-2,6-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Dimethyl-7-octyne-2,6-diol?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Dimethyl-7-octyne-2,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.