2,6-Dimethyl-3-heptanol
TL;DR: 2,6-Dimethyl-3-heptanol (CAS 19549-73-6) is a chemical compound with molecular formula C9H20O and molecular weight 144.15141 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,6-dimethylheptan-3-ol
Also Known As: 2,6-DIMETHYL-3-HEPTANOL, 2,6-dimethylheptan-3-ol, 3-Heptanol, 2,6-dimethyl-, 2,6-dimethyl-heptan-3-ol, 3-Heptanol,2,6-dimethyl-
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H20O |
| Molecular Weight | 144.15141 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 144.15141 Da |
| Heavy Atoms | 10 |
| Complexity | 76.0 |
| SMILES | CC(C)CCC(C(C)C)O |
| InChIKey | XZDMJRIWJSNEGC-UHFFFAOYSA-N |
Chemical Property Profile of 2,6-Dimethyl-3-heptanol
Property Insights of 2,6-Dimethyl-3-heptanol
The XLogP value of 3.0 indicates that 2,6-Dimethyl-3-heptanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2,6-Dimethyl-3-heptanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Dimethyl-3-heptanol has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,6-Dimethyl-3-heptanol?
The CAS number of 2,6-Dimethyl-3-heptanol is 19549-73-6.
What is the molecular formula of 2,6-Dimethyl-3-heptanol?
The molecular formula of 2,6-Dimethyl-3-heptanol is C9H20O.
What is the molecular weight of 2,6-Dimethyl-3-heptanol?
The molecular weight of 2,6-Dimethyl-3-heptanol is 144.15141 g/mol.
Where can I buy 2,6-Dimethyl-3-heptanol?
You can request a quote for 2,6-Dimethyl-3-heptanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,6-Dimethyl-3-heptanol?
Yes, CoreyChem provides custom synthesis services for 2,6-Dimethyl-3-heptanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.