(2S)-4,4-dimethylpentan-2-ol
TL;DR: (2S)-4,4-dimethylpentan-2-ol (CAS 61184-91-6) is a chemical compound with molecular formula C7H16O and molecular weight 116.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-4,4-dimethylpentan-2-ol
Also Known As: (2S)-4,4-dimethylpentan-2-ol, (s)-4,4-dimethyl-2-pentanol, (S)-4,4-dimethylpentan-2-ol, [S,(+)]-4,4-Dimethyl-2-pentanol, 2-Pentanol, 4,4-dimethyl-, (2S)-
| Molecular Formula | C7H16O |
|---|---|
| Molecular Weight | 116.12 g/mol |
| LogP | 1.8034 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 116.12012 |
| Heavy Atoms | 8 |
| Complexity | 59.2773 |
Chemical Identifiers
| CAS Number | 61184-91-6 |
|---|---|
| SMILES | C[C@@H](CC(C)(C)C)O |
Product Overview
(2S)-4,4-dimethylpentan-2-ol (CAS 61184-91-6), with molecular formula C7H16O and molecular weight 116.12 g/mol. IUPAC: (2S)-4,4-dimethylpentan-2-ol.
Chemical Property Profile of (2S)-4,4-dimethylpentan-2-ol
Property Insights of (2S)-4,4-dimethylpentan-2-ol
The XLogP value of 1.8034 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S)-4,4-dimethylpentan-2-ol. With a topological polar surface area (TPSA) of 20.23 Ų, (2S)-4,4-dimethylpentan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S)-4,4-dimethylpentan-2-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 (2S)-4,4-dimethylpentan-2-ol?
The CAS number of (2S)-4,4-dimethylpentan-2-ol is 61184-91-6.
What is the molecular formula of (2S)-4,4-dimethylpentan-2-ol?
The molecular formula of (2S)-4,4-dimethylpentan-2-ol is C7H16O.
What is the molecular weight of (2S)-4,4-dimethylpentan-2-ol?
The molecular weight of (2S)-4,4-dimethylpentan-2-ol is 116.12 g/mol.
Where can I buy (2S)-4,4-dimethylpentan-2-ol?
You can request a quote for (2S)-4,4-dimethylpentan-2-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S)-4,4-dimethylpentan-2-ol?
Yes, KEHONG BIO provides custom synthesis services for (2S)-4,4-dimethylpentan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.