1,4,6,7-Tetramethylnaphthalene
TL;DR: 1,4,6,7-Tetramethylnaphthalene (CAS 100516-01-6) is a chemical compound with molecular formula C14H16 and molecular weight 184.1252 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,4,6,7-tetramethylnaphthalene
Also Known As: 1,4,6,7-Tetramethylnaphthalene, 2-IodohippuricAcid, Naphthalene, 1,4,6,7-tetramethyl-, 2,3,5,8-Tetramethylnaphthalene, 1,4,6,7-Tetramethyl naphthalene
Technical Specifications
| Molecular Formula | C14H16 |
| Molecular Weight | 184.1252 g/mol |
| XLogP | 4.6 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 184.1252 Da |
| Heavy Atoms | 14 |
| Complexity | 174.0 |
| SMILES | CC1=C2C=C(C(=CC2=C(C=C1)C)C)C |
| InChIKey | VPSPONOBLZCLIU-UHFFFAOYSA-N |
Chemical Property Profile of 1,4,6,7-Tetramethylnaphthalene
Property Insights of 1,4,6,7-Tetramethylnaphthalene
The XLogP value of 4.6 indicates that 1,4,6,7-Tetramethylnaphthalene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 1,4,6,7-Tetramethylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,4,6,7-Tetramethylnaphthalene 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
What is the CAS number of 1,4,6,7-Tetramethylnaphthalene?
The CAS number of 1,4,6,7-Tetramethylnaphthalene is 100516-01-6.
What is the molecular formula of 1,4,6,7-Tetramethylnaphthalene?
The molecular formula of 1,4,6,7-Tetramethylnaphthalene is C14H16.
What is the molecular weight of 1,4,6,7-Tetramethylnaphthalene?
The molecular weight of 1,4,6,7-Tetramethylnaphthalene is 184.1252 g/mol.
Where can I buy 1,4,6,7-Tetramethylnaphthalene?
You can request a quote for 1,4,6,7-Tetramethylnaphthalene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1,4,6,7-Tetramethylnaphthalene?
Yes, CoreyChem provides custom synthesis services for 1,4,6,7-Tetramethylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.