3-己醇
TL;DR: 3-己醇 (CAS 623-37-0) is a chemical compound with molecular formula C6H14O and molecular weight 102.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-己醇
hexan-3-ol
Also Known As: 3-HEXANOL, Hexan-3-ol, Ethyl propyl carbinol, 3-Hexyl alcohol, Ethylpropylcarbinol
| Molecular Formula | C6H14O |
|---|---|
| Molecular Weight | 102.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 102.10446 |
| Heavy Atoms | 7 |
| Complexity | 35.0 |
| Boiling Point | 133.00 to 135.00 °C. @ 760.00 mm Hg |
| Density | 0.818-0.822 (20°) |
| Solubility | 16.1 mg/mL at 25 °C |
| Vapor Pressure | 4.81 [mmHg] |
| Refractive Index | 1.414-1.418 |
Chemical Identifiers
| CAS Number | 623-37-0 |
|---|---|
| SMILES | CCCC(CC)O |
| InChIKey | ZOCHHNOQQHDWHG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-己醇 (CAS 623-37-0), with molecular formula C6H14O and molecular weight 102.10 g/mol. IUPAC: hexan-3-ol.
Chemical Property Profile of 3-己醇
Property Insights of 3-己醇
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-己醇. With a topological polar surface area (TPSA) of 20.2 Ų, 3-己醇 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-己醇 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 3-己醇?
The CAS number of 3-己醇 is 623-37-0.
What is the molecular formula of 3-己醇?
The molecular formula of 3-己醇 is C6H14O.
What is the molecular weight of 3-己醇?
The molecular weight of 3-己醇 is 102.10 g/mol.
Where can I buy 3-己醇?
You can request a quote for 3-己醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-己醇?
Yes, KEHONG BIO provides custom synthesis services for 3-己醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.