3,5-Bis(trifluoromethyl)benzoyl chloride
TL;DR: 3,5-Bis(trifluoromethyl)benzoyl chloride (CAS 785-56-8) is a chemical compound with molecular formula C9H3ClF6O and molecular weight 275.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,5-bis(trifluoromethyl)benzoyl chloride
Also Known As: 3,5-Bis(trifluoromethyl)benzoyl chloride, fxffr cvg exfff, Titanocene dichloride, 3,5-bis(trifluoromethyl)benzoylchloride, 4-Aminophenethyl alcohol
| Molecular Formula | C9H3ClF6O |
|---|---|
| Molecular Weight | 275.98 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 17.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 275.97766 |
| Heavy Atoms | 17 |
| Complexity | 275.0 |
Chemical Identifiers
| CAS Number | 785-56-8 |
|---|---|
| SMILES | C1=C(C=C(C=C1C(F)(F)F)C(F)(F)F)C(=O)Cl |
| InChIKey | WAKMMQSMEDJRRI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3,5-Bis(trifluoromethyl)benzoyl chloride (CAS 785-56-8), with molecular formula C9H3ClF6O and molecular weight 275.98 g/mol. IUPAC: 3,5-bis(trifluoromethyl)benzoyl chloride.
Chemical Property Profile of 3,5-Bis(trifluoromethyl)benzoyl chloride
Property Insights of 3,5-Bis(trifluoromethyl)benzoyl chloride
The XLogP value of 4.8 indicates that 3,5-Bis(trifluoromethyl)benzoyl chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.1 Ų, 3,5-Bis(trifluoromethyl)benzoyl chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,5-Bis(trifluoromethyl)benzoyl chloride has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,5-Bis(trifluoromethyl)benzoyl chloride?
The CAS number of 3,5-Bis(trifluoromethyl)benzoyl chloride is 785-56-8.
What is the molecular formula of 3,5-Bis(trifluoromethyl)benzoyl chloride?
The molecular formula of 3,5-Bis(trifluoromethyl)benzoyl chloride is C9H3ClF6O.
What is the molecular weight of 3,5-Bis(trifluoromethyl)benzoyl chloride?
The molecular weight of 3,5-Bis(trifluoromethyl)benzoyl chloride is 275.98 g/mol.
Where can I buy 3,5-Bis(trifluoromethyl)benzoyl chloride?
You can request a quote for 3,5-Bis(trifluoromethyl)benzoyl chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Bis(trifluoromethyl)benzoyl chloride?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Bis(trifluoromethyl)benzoyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.