2,4-Dimethyl-4-octanol
TL;DR: 2,4-Dimethyl-4-octanol (CAS 339348-11-7) is a chemical compound with molecular formula C10H22O and molecular weight 158.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4-dimethyloctan-4-ol
Also Known As: 2,4-Dimethyl-4-octanol, 2,4-dimethyloctan-4-ol, 4-Octanol, 2,4-dimethyl-, 2,4-dimethyl-octan-4-ol, 3-amino-3-(4-propylphenyl)propanoic acid
| Molecular Formula | C10H22O |
|---|---|
| Molecular Weight | 158.17 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 158.16707 |
| Heavy Atoms | 11 |
| Complexity | 99.0 |
Chemical Identifiers
| CAS Number | 339348-11-7 |
|---|---|
| SMILES | CCCCC(C)(CC(C)C)O |
| InChIKey | VRFMFHBPJUSGFK-UHFFFAOYSA-N |
Product Overview
2,4-Dimethyl-4-octanol (CAS 339348-11-7), with molecular formula C10H22O and molecular weight 158.17 g/mol. IUPAC: 2,4-dimethyloctan-4-ol.
Chemical Property Profile of 2,4-Dimethyl-4-octanol
Property Insights of 2,4-Dimethyl-4-octanol
The XLogP value of 3.3 indicates that 2,4-Dimethyl-4-octanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, 2,4-Dimethyl-4-octanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dimethyl-4-octanol 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
Frequently Asked Questions
What is the CAS number of 2,4-Dimethyl-4-octanol?
The CAS number of 2,4-Dimethyl-4-octanol is 339348-11-7.
What is the molecular formula of 2,4-Dimethyl-4-octanol?
The molecular formula of 2,4-Dimethyl-4-octanol is C10H22O.
What is the molecular weight of 2,4-Dimethyl-4-octanol?
The molecular weight of 2,4-Dimethyl-4-octanol is 158.17 g/mol.
Where can I buy 2,4-Dimethyl-4-octanol?
You can request a quote for 2,4-Dimethyl-4-octanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,4-Dimethyl-4-octanol?
Yes, KEHONG BIO provides custom synthesis services for 2,4-Dimethyl-4-octanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.