1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol
TL;DR: 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol (CAS 20583-04-4) is a chemical compound with molecular formula C30H22O2 and molecular weight 414.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol
Also Known As: 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol, 1,1,6,6-Tetraphenyl-2,4-hexadiyne-1,6-diol, 2,4-HEXADIYNE-1,6-DIOL, 1,1,6,6-TETRAPHENYL-, tetraphenylhexa-2,4-diyne-1,6-diol, 1,3-Butadiyne-1,4-diylbis(diphenylmethanol)
| Molecular Formula | C30H22O2 |
|---|---|
| Molecular Weight | 414.16 g/mol |
| LogP | 5.7 |
| Topological Polar Surface Area | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.162 |
| Heavy Atoms | 32 |
| Complexity | 616.0 |
Chemical Identifiers
| CAS Number | 20583-04-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(C#CC#CC(C2=CC=CC=C2)(C3=CC=CC=C3)O)(C4=CC=CC=C4)O |
| InChIKey | WXTPRAZNOXQAFY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol (CAS 20583-04-4), with molecular formula C30H22O2 and molecular weight 414.16 g/mol. IUPAC: 1,1,6,6-tetraphenylhexa-2,4-diyne-1,6-diol.
Chemical Property Profile of 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol
Property Insights of 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol
The XLogP value of 5.7 indicates that 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.5 Ų, 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol?
The CAS number of 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol is 20583-04-4.
What is the molecular formula of 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol?
The molecular formula of 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol is C30H22O2.
What is the molecular weight of 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol?
The molecular weight of 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol is 414.16 g/mol.
Where can I buy 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol?
You can request a quote for 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol?
Yes, KEHONG BIO provides custom synthesis services for 1,1,6,6-Tetraphenylhexa-2,4-diyne-1,6-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.