Chlorophene
TL;DR: Chlorophene (CAS 120-32-1) is a chemical compound with molecular formula C13H11ClO and molecular weight 218.04984 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzyl-4-chlorophenol
Also Known As: 2-Benzyl-4-chlorophenol, Clorophene, Clorofene, Chlorophene, Neosabenyl
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C13H11ClO |
| Molecular Weight | 218.04984 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.04984 Da |
| Heavy Atoms | 15 |
| Complexity | 189.0 |
| Melting Point | 119.3 °F (NTP, 1992) |
| Boiling Point | 320 to 324 °F at 3.5 mmHg (NTP, 1992) |
| Density | 1.22 (NTP, 1992) - Denser than water; will sink |
| Flash Point | 370 °F (NTP, 1992) |
| Vapor Pressure | 0.1 mmHg at 68 °F (NTP, 1992) |
| Solubility | less than 1 mg/mL at 61 °F (NTP, 1992) |
| SMILES | C1=CC=C(C=C1)CC2=C(C=CC(=C2)Cl)O |
| InChIKey | NCKMMSIFQUPKCK-UHFFFAOYSA-N |
Product Description
Applications: Chlorophene is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Chlorophene (CAS 120-32-1) with custom synthesis available from milligram to multi-kilogram scale, supported by COA, MSDS, and HPLC/NMR/MS documentation.
Chlorophene (CAS 120-32-1) is a pharmaceutical intermediate with the molecular formula C13H11ClO and a molecular weight of 218.05 g/mol. Key physical properties include a density of 1.22 (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: less than 1 mg/mL at 61 °F (NTP, 1992). It is also known as 2-Benzyl-4-chlorophenol and Clorophene.
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 Chlorophene
Property Insights of Chlorophene
The XLogP value of 4.0 indicates that Chlorophene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.2 Ų, Chlorophene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlorophene has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Chlorophene?
The CAS number of Chlorophene is 120-32-1.
What is the molecular formula of Chlorophene?
The molecular formula of Chlorophene is C13H11ClO.
What is the molecular weight of Chlorophene?
The molecular weight of Chlorophene is 218.04984 g/mol.
What are the applications of Chlorophene?
Chlorophene is used in pharmaceutical synthesis routes and API production, as well as surfactant and detergent formulations. It commonly serves as a versatile building block for organic synthesis. CoreyChem supplies Chlorophene (CAS 120-32-1) with custom synthesis available from milligram to...
Where can I buy Chlorophene?
You can request a quote for Chlorophene directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Chlorophene?
Yes, CoreyChem provides custom synthesis services for Chlorophene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.