5-Ethyl-5-methylheptan-1-ol
TL;DR: 5-Ethyl-5-methylheptan-1-ol (CAS 85391-45-3) 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.
5-ethyl-5-methylheptan-1-ol
Also Known As: 5-Ethyl-5-methylheptan-1-ol, 5,5-DIETHYL-1-HEXANOL, EINECS 286-799-9, 5-Ethyl-5-methyl-1-heptanol, 1-Heptanol,5-ethyl-5-methyl-
| Molecular Formula | C10H22O |
|---|---|
| Molecular Weight | 158.17 g/mol |
| LogP | 2.9753 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 158.16707 |
| Heavy Atoms | 11 |
| Complexity | 84.873566 |
Chemical Identifiers
| CAS Number | 85391-45-3 |
|---|---|
| SMILES | CCC(C)(CC)CCCCO |
Product Overview
5-Ethyl-5-methylheptan-1-ol (CAS 85391-45-3), with molecular formula C10H22O and molecular weight 158.17 g/mol. IUPAC: 5-ethyl-5-methylheptan-1-ol.
Chemical Property Profile of 5-Ethyl-5-methylheptan-1-ol
Property Insights of 5-Ethyl-5-methylheptan-1-ol
The XLogP value of 2.9753 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Ethyl-5-methylheptan-1-ol. With a topological polar surface area (TPSA) of 20.23 Ų, 5-Ethyl-5-methylheptan-1-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Ethyl-5-methylheptan-1-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
Frequently Asked Questions
What is the CAS number of 5-Ethyl-5-methylheptan-1-ol?
The CAS number of 5-Ethyl-5-methylheptan-1-ol is 85391-45-3.
What is the molecular formula of 5-Ethyl-5-methylheptan-1-ol?
The molecular formula of 5-Ethyl-5-methylheptan-1-ol is C10H22O.
What is the molecular weight of 5-Ethyl-5-methylheptan-1-ol?
The molecular weight of 5-Ethyl-5-methylheptan-1-ol is 158.17 g/mol.
Where can I buy 5-Ethyl-5-methylheptan-1-ol?
You can request a quote for 5-Ethyl-5-methylheptan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Ethyl-5-methylheptan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 5-Ethyl-5-methylheptan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.