2-Fluorobenzoyl chloride
TL;DR: 2-Fluorobenzoyl chloride (CAS 393-52-2) is a chemical compound with molecular formula C7H4ClFO and molecular weight 157.99347 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-fluorobenzoyl chloride
Also Known As: 2-FLUOROBENZOYL CHLORIDE, o-Fluorobenzoyl chloride, Benzoyl chloride, 2-fluoro-, 2-fluorobenzoylchloride, Benzoyl chloride, o-fluoro-
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H4ClFO |
| Molecular Weight | 157.99347 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.99347 Da |
| Heavy Atoms | 10 |
| Complexity | 138.0 |
| Melting Point | 39 °F (NTP, 1992) |
| Boiling Point | 403 °F at 760 mmHg (NTP, 1992) |
| Density | 1.304 at 68 °F (NTP, 1992) - Denser than water; will sink |
| Flash Point | 180 °F (NTP, 1992) |
| Vapor Pressure | 0.46 [mmHg] |
| Refractive Index | Index of refraction: 1.5365 at 20 °C/D |
| Solubility | Decomposes (NTP, 1992) |
| SMILES | C1=CC=C(C(=C1)C(=O)Cl)F |
| InChIKey | RAAGZOYMEQDCTD-UHFFFAOYSA-N |
Product Description
Applications: 2-Fluorobenzoyl chloride 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).
A heterocyclic building block supplied by CoreyChem, 2-Fluorobenzoyl chloride (CAS 393-52-2) has the molecular formula C7H4ClFO and a molecular weight of 157.99 g/mol. Reported properties include a density of 1.304 at 68 °F (NTP, 1992) - Denser than water; will sink g/cm³, a solubility: Decomposes (NTP, 1992). Synonyms include 2-FLUOROBENZOYL CHLORIDE and o-Fluorobenzoyl chloride.
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 2-Fluorobenzoyl chloride
Property Insights of 2-Fluorobenzoyl chloride
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Fluorobenzoyl chloride. With a topological polar surface area (TPSA) of 17.1 Ų, 2-Fluorobenzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Fluorobenzoyl chloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2-Fluorobenzoyl chloride?
The CAS number of 2-Fluorobenzoyl chloride is 393-52-2.
What is the molecular formula of 2-Fluorobenzoyl chloride?
The molecular formula of 2-Fluorobenzoyl chloride is C7H4ClFO.
What is the molecular weight of 2-Fluorobenzoyl chloride?
The molecular weight of 2-Fluorobenzoyl chloride is 157.99347 g/mol.
What are the applications of 2-Fluorobenzoyl chloride?
2-Fluorobenzoyl chloride 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...
Where can I buy 2-Fluorobenzoyl chloride?
You can request a quote for 2-Fluorobenzoyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Fluorobenzoyl chloride?
Yes, CoreyChem provides custom synthesis services for 2-Fluorobenzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.