2,5-己二醇
TL;DR: 2,5-己二醇 (CAS 2935-44-6) is a chemical compound with molecular formula C6H14O2 and molecular weight 118.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-己二醇
hexane-2,5-diol
Also Known As: hexane-2,5-diol, 2,5-HEXANEDIOL, Diisopropanol, 2,5-Dihydroxyhexane, 2,4-Hexanediol
| Molecular Formula | C6H14O2 |
|---|---|
| Molecular Weight | 118.10 g/mol |
| LogP | 0.4 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 118.09938 |
| Heavy Atoms | 8 |
| Complexity | 46.0 |
| Melting Point | 43 °C |
| Boiling Point | 216 °C |
| Density | Relative density (water = 1): 0.97 |
| Solubility | Solubility in water: freely soluble |
| Flash Point | 101 °C |
Chemical Identifiers
| CAS Number | 2935-44-6 |
|---|---|
| SMILES | CC(CCC(C)O)O |
| InChIKey | OHMBHFSEKCCCBW-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,5-己二醇 (CAS 2935-44-6), with molecular formula C6H14O2 and molecular weight 118.10 g/mol. IUPAC: hexane-2,5-diol.
Chemical Property Profile of 2,5-己二醇
Property Insights of 2,5-己二醇
The XLogP value of 0.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-己二醇. With a topological polar surface area (TPSA) of 40.5 Ų, 2,5-己二醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-己二醇 has 2 hydrogen bond donor(s) and 2 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 2,5-己二醇?
The CAS number of 2,5-己二醇 is 2935-44-6.
What is the molecular formula of 2,5-己二醇?
The molecular formula of 2,5-己二醇 is C6H14O2.
What is the molecular weight of 2,5-己二醇?
The molecular weight of 2,5-己二醇 is 118.10 g/mol.
Where can I buy 2,5-己二醇?
You can request a quote for 2,5-己二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-己二醇?
Yes, KEHONG BIO provides custom synthesis services for 2,5-己二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.