2,3-Hexanediol
TL;DR: 2,3-Hexanediol (CAS 70859-22-2) 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.
hexane-2,3-diol
Also Known As: 2,3-Hexanediol, hexane-2,3-diol, 2,3-Dihydroxyhexane, RS-2,3-hexanediol, 2,3-Hexanediol #
| Molecular Formula | C6H14O2 |
|---|---|
| Molecular Weight | 118.10 g/mol |
| LogP | 0.6 |
| 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 | 54.0 |
Chemical Identifiers
| CAS Number | 70859-22-2 |
|---|---|
| SMILES | CCCC(C(C)O)O |
| InChIKey | QCIYAEYRVFUFAP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 20 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,3-Hexanediol (CAS 70859-22-2), with molecular formula C6H14O2 and molecular weight 118.10 g/mol. IUPAC: hexane-2,3-diol.
Chemical Property Profile of 2,3-Hexanediol
Property Insights of 2,3-Hexanediol
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Hexanediol. With a topological polar surface area (TPSA) of 40.5 Ų, 2,3-Hexanediol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3-Hexanediol 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 2,3-Hexanediol?
The CAS number of 2,3-Hexanediol is 70859-22-2.
What is the molecular formula of 2,3-Hexanediol?
The molecular formula of 2,3-Hexanediol is C6H14O2.
What is the molecular weight of 2,3-Hexanediol?
The molecular weight of 2,3-Hexanediol is 118.10 g/mol.
Where can I buy 2,3-Hexanediol?
You can request a quote for 2,3-Hexanediol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3-Hexanediol?
Yes, KEHONG BIO provides custom synthesis services for 2,3-Hexanediol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.