Halocarban
TL;DR: Halocarban (CAS 369-77-7) is a chemical compound with molecular formula C14H9Cl2F3N2O and molecular weight 348.0044 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-(4-chlorophenyl)-3-[4-chloro-3-(trifluoromethyl)phenyl]urea
Also Known As: Halocarban, Cloflucarban, Halocarbano, Cloflucarbon, Halocarbanum
Application Areas
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C14H9Cl2F3N2O |
| Molecular Weight | 348.0044 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 348.0044 Da |
| Heavy Atoms | 22 |
| Complexity | 387.0 |
| SMILES | C1=CC(=CC=C1NC(=O)NC2=CC(=C(C=C2)Cl)C(F)(F)F)Cl |
| InChIKey | ZFSXZJXLKAJIGS-UHFFFAOYSA-N |
Product Description
Applications: Halocarban 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. 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 pharmaceutical intermediate supplied by CoreyChem, Halocarban (CAS 369-77-7) has the molecular formula C14H9Cl2F3N2O and a molecular weight of 348 g/mol. Synonyms include Halocarban and Cloflucarban.
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 Halocarban
Property Insights of Halocarban
The XLogP value of 5.3 indicates that Halocarban is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.1 Ų, Halocarban exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Halocarban has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Halocarban?
The CAS number of Halocarban is 369-77-7.
What is the molecular formula of Halocarban?
The molecular formula of Halocarban is C14H9Cl2F3N2O.
What is the molecular weight of Halocarban?
The molecular weight of Halocarban is 348.0044 g/mol.
What are the applications of Halocarban?
Halocarban 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. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with...
Where can I buy Halocarban?
You can request a quote for Halocarban directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Halocarban?
Yes, CoreyChem provides custom synthesis services for Halocarban and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.