1-Chloro-2-methylnaphthalene
TL;DR: 1-Chloro-2-methylnaphthalene (CAS 112494-52-7) is a chemical compound with molecular formula C11H9Cl and molecular weight 176.03928 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-chloro-2-methylnaphthalene
Also Known As: 1-Chloro-2-methylnaphthalene, 1-chloro-2-methyl-naphthalene, Naphthalene, 1-chloro-2-methyl-, taxifolin-6-C-glucoside, 1-Chloro-2-methyl naphthalene
Application Areas
Top 5 of 10 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H9Cl |
| Molecular Weight | 176.03928 g/mol |
| XLogP | 4.2 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 176.03928 Da |
| Heavy Atoms | 12 |
| Complexity | 155.0 |
| SMILES | CC1=C(C2=CC=CC=C2C=C1)Cl |
| InChIKey | MNCMVFFWMBXFLK-UHFFFAOYSA-N |
Chemical Property Profile of 1-Chloro-2-methylnaphthalene
Property Insights of 1-Chloro-2-methylnaphthalene
The XLogP value of 4.2 indicates that 1-Chloro-2-methylnaphthalene 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-Chloro-2-methylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-2-methylnaphthalene 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-Chloro-2-methylnaphthalene?
The CAS number of 1-Chloro-2-methylnaphthalene is 112494-52-7.
What is the molecular formula of 1-Chloro-2-methylnaphthalene?
The molecular formula of 1-Chloro-2-methylnaphthalene is C11H9Cl.
What is the molecular weight of 1-Chloro-2-methylnaphthalene?
The molecular weight of 1-Chloro-2-methylnaphthalene is 176.03928 g/mol.
Where can I buy 1-Chloro-2-methylnaphthalene?
You can request a quote for 1-Chloro-2-methylnaphthalene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Chloro-2-methylnaphthalene?
Yes, CoreyChem provides custom synthesis services for 1-Chloro-2-methylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.