4,12-Tetradecadiene-8,10-diyne-1,6,7-triol
TL;DR: 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol (CAS 136171-87-4) is a chemical compound with molecular formula C14H18O3 and molecular weight 234.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
tetradeca-4,12-dien-8,10-diyne-1,6,7-triol
Also Known As: Lobetyol, 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol, tetradeca-4,12-dien-8,10-diyne-1,6,7-triol, Tetradeca-4,12-diene-8,10-diyne-1,6,7-triol, (4E,12E)-tetradeca-4,12-dien-8,10-diyne-1,6,7-triol
| Molecular Formula | C14H18O3 |
|---|---|
| Molecular Weight | 234.13 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 234.1256 |
| Heavy Atoms | 17 |
| Complexity | 381.0 |
Chemical Identifiers
| CAS Number | 136171-87-4 |
|---|---|
| SMILES | CC=CC#CC#CC(C(C=CCCCO)O)O |
| InChIKey | RKOQCMNXJZJWBU-UHFFFAOYSA-N |
Product Overview
4,12-Tetradecadiene-8,10-diyne-1,6,7-triol (CAS 136171-87-4), with molecular formula C14H18O3 and molecular weight 234.13 g/mol. IUPAC: tetradeca-4,12-dien-8,10-diyne-1,6,7-triol.
Chemical Property Profile of 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol
Property Insights of 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol. The TPSA of 60.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol. Following Lipinski's Rule of Five, 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol has 3 hydrogen bond donor(s) and 3 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 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol?
The CAS number of 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol is 136171-87-4.
What is the molecular formula of 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol?
The molecular formula of 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol is C14H18O3.
What is the molecular weight of 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol?
The molecular weight of 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol is 234.13 g/mol.
Where can I buy 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol?
You can request a quote for 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol?
Yes, KEHONG BIO provides custom synthesis services for 4,12-Tetradecadiene-8,10-diyne-1,6,7-triol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.