6-Methylheptan-3-ol
TL;DR: 6-Methylheptan-3-ol (CAS 18720-66-6) is a chemical compound with molecular formula C8H18O and molecular weight 130.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-methylheptan-3-ol
Also Known As: 6-Methylheptan-3-ol, 6-Methyl-3-heptanol, 3-Heptanol, 6-methyl-, Ethylisoamylcarbinol, 2-Methyl-5-heptanol
Application Areas
Top 5 of 13 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H18O |
| Molecular Weight | 130.13577 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 130.13577 Da |
| Heavy Atoms | 9 |
| Complexity | 59.0 |
| SMILES | CCC(CCC(C)C)O |
| InChIKey | MNBIBGDICHMQFN-UHFFFAOYSA-N |
Chemical Property Profile of 6-Methylheptan-3-ol
Property Insights of 6-Methylheptan-3-ol
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Methylheptan-3-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 6-Methylheptan-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Methylheptan-3-ol 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 6-Methylheptan-3-ol?
The CAS number of 6-Methylheptan-3-ol is 18720-66-6.
What is the molecular formula of 6-Methylheptan-3-ol?
The molecular formula of 6-Methylheptan-3-ol is C8H18O.
What is the molecular weight of 6-Methylheptan-3-ol?
The molecular weight of 6-Methylheptan-3-ol is 130.13577 g/mol.
Where can I buy 6-Methylheptan-3-ol?
You can request a quote for 6-Methylheptan-3-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-Methylheptan-3-ol?
Yes, CoreyChem provides custom synthesis services for 6-Methylheptan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.