CTK0J1700
TL;DR: CTK0J1700 (CAS 55976-12-0) is a chemical compound with molecular formula C12H20 and molecular weight 164.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2,7,7-tetramethyloct-3-en-5-yne
Also Known As: 2,2,7,7-Tetramethyl-3-octen-5-yne, 3-Octen-5-yne, 2,2,7,7-tetramethyl-, 2,2,7,7-TETRAMETHYLOCT-3-EN-5-YNE, 3-Octen-5-yne, 2,2,7,7-tetramethyl-, (3E)-, 3-Octen-5-yne, 2,2,7,7-tetramethyl-, (3Z)-
| Molecular Formula | C12H20 |
|---|---|
| Molecular Weight | 164.16 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.1565 |
| Heavy Atoms | 12 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 55976-12-0 |
|---|---|
| SMILES | CC(C)(C)C=CC#CC(C)(C)C |
| InChIKey | SJKGMWBQDQMRKQ-UHFFFAOYSA-N |
Product Overview
CTK0J1700 (CAS 55976-12-0), with molecular formula C12H20 and molecular weight 164.16 g/mol. IUPAC: 2,2,7,7-tetramethyloct-3-en-5-yne.
Chemical Property Profile of CTK0J1700
Property Insights of CTK0J1700
The XLogP value of 4.7 indicates that CTK0J1700 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, CTK0J1700 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CTK0J1700 has 0 hydrogen bond donor(s) and 0 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 CTK0J1700?
The CAS number of CTK0J1700 is 55976-12-0.
What is the molecular formula of CTK0J1700?
The molecular formula of CTK0J1700 is C12H20.
What is the molecular weight of CTK0J1700?
The molecular weight of CTK0J1700 is 164.16 g/mol.
Where can I buy CTK0J1700?
You can request a quote for CTK0J1700 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for CTK0J1700?
Yes, KEHONG BIO provides custom synthesis services for CTK0J1700 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.