Phthaloyl chloride
TL;DR: Phthaloyl chloride (CAS 88-95-9) is a chemical compound with molecular formula C8H4Cl2O2 and molecular weight 201.95883 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzene-1,2-dicarbonyl chloride
Also Known As: Phthaloyl dichloride, PHTHALOYL CHLORIDE, Phthalic chloride, Phthalyl chloride, Phthalic dichloride
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H4Cl2O2 |
| Molecular Weight | 201.95883 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 34.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 201.95883 Da |
| Heavy Atoms | 12 |
| Complexity | 181.0 |
| Boiling Point | 281.1 °C @760 [mm Hg] |
| Density | 1.409 @25 °C |
| Vapor Pressure | 30 [mm Hg] @47 °C |
| SMILES | C1=CC=C(C(=C1)C(=O)Cl)C(=O)Cl |
| InChIKey | FYXKZNLBZKRYSS-UHFFFAOYSA-N |
Product Description
Applications: Phthaloyl chloride is used in polymer chemistry and functional materials synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. 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 polymer intermediate supplied by CoreyChem, Phthaloyl chloride (CAS 88-95-9) has the molecular formula C8H4Cl2O2 and a molecular weight of 201.96 g/mol. Reported properties include a density of 1.409 @25 °C g/cm³. Synonyms include Phthaloyl dichloride and PHTHALOYL 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 Phthaloyl chloride
Property Insights of Phthaloyl chloride
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phthaloyl chloride. With a topological polar surface area (TPSA) of 34.1 Ų, Phthaloyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phthaloyl 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 Phthaloyl chloride?
The CAS number of Phthaloyl chloride is 88-95-9.
What is the molecular formula of Phthaloyl chloride?
The molecular formula of Phthaloyl chloride is C8H4Cl2O2.
What is the molecular weight of Phthaloyl chloride?
The molecular weight of Phthaloyl chloride is 201.95883 g/mol.
What are the applications of Phthaloyl chloride?
Phthaloyl chloride is used in polymer chemistry and functional materials synthesis, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Phthaloyl chloride?
You can request a quote for Phthaloyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phthaloyl chloride?
Yes, CoreyChem provides custom synthesis services for Phthaloyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.