1-Chloromethylnaphthalene
TL;DR: 1-Chloromethylnaphthalene (CAS 86-52-2) 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-(chloromethyl)naphthalene
Also Known As: 1-(CHLOROMETHYL)NAPHTHALENE, 1-Chloromethyl naphthalene, 1-Chloromethylnaphthalene, 1-Naphthylmethyl chloride, 1-Menaphthyl chloride
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H9Cl |
| Molecular Weight | 176.03928 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 176.03928 Da |
| Heavy Atoms | 12 |
| Complexity | 144.0 |
| SMILES | C1=CC=C2C(=C1)C=CC=C2CCl |
| InChIKey | XMWGTKZEDLCVIG-UHFFFAOYSA-N |
Product Description
Applications: 1-Chloromethylnaphthalene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
1-Chloromethylnaphthalene (CAS 86-52-2) is a heterocyclic building block with the molecular formula C11H9Cl and a molecular weight of 176.04 g/mol. Synonyms include 1-(CHLOROMETHYL)NAPHTHALENE and 1-Chloromethyl naphthalene.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 1-Chloromethylnaphthalene
Property Insights of 1-Chloromethylnaphthalene
The XLogP value of 3.7 indicates that 1-Chloromethylnaphthalene 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-Chloromethylnaphthalene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloromethylnaphthalene 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-Chloromethylnaphthalene?
The CAS number of 1-Chloromethylnaphthalene is 86-52-2.
What is the molecular formula of 1-Chloromethylnaphthalene?
The molecular formula of 1-Chloromethylnaphthalene is C11H9Cl.
What is the molecular weight of 1-Chloromethylnaphthalene?
The molecular weight of 1-Chloromethylnaphthalene is 176.03928 g/mol.
What are the applications of 1-Chloromethylnaphthalene?
1-Chloromethylnaphthalene is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item...
Where can I buy 1-Chloromethylnaphthalene?
You can request a quote for 1-Chloromethylnaphthalene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Chloromethylnaphthalene?
Yes, CoreyChem provides custom synthesis services for 1-Chloromethylnaphthalene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.