3-Trifluoromethylbenzoic anhydride
TL;DR: 3-Trifluoromethylbenzoic anhydride (CAS 25753-15-5) is a chemical compound with molecular formula C16H8F6O3 and molecular weight 362.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(trifluoromethyl)benzoyl] 3-(trifluoromethyl)benzoate
Also Known As: 3-Trifluoromethylbenzoic anhydride, 3-(Trifluoromethyl)benzoic anhydride, 3-(Trifluoromethyl)benzoicanhydride, [3-(trifluoromethyl)benzoyl] 3-(trifluoromethyl)benzoate, 3-(Trifluoromethyl)phenyl anhydride #
| Molecular Formula | C16H8F6O3 |
|---|---|
| Molecular Weight | 362.04 g/mol |
| LogP | 5.0 |
| Topological Polar Surface Area | 43.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 4 |
| Exact Mass | 362.03775 |
| Heavy Atoms | 25 |
| Complexity | 455.0 |
Chemical Identifiers
| CAS Number | 25753-15-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)C(F)(F)F)C(=O)OC(=O)C2=CC(=CC=C2)C(F)(F)F |
| InChIKey | BYLMYFXAIMTZIC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Trifluoromethylbenzoic anhydride (CAS 25753-15-5), with molecular formula C16H8F6O3 and molecular weight 362.04 g/mol. IUPAC: [3-(trifluoromethyl)benzoyl] 3-(trifluoromethyl)benzoate.
Chemical Property Profile of 3-Trifluoromethylbenzoic anhydride
Property Insights of 3-Trifluoromethylbenzoic anhydride
The XLogP value of 5.0 indicates that 3-Trifluoromethylbenzoic anhydride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.4 Ų, 3-Trifluoromethylbenzoic anhydride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Trifluoromethylbenzoic anhydride has 0 hydrogen bond donor(s) and 9 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-Trifluoromethylbenzoic anhydride?
The CAS number of 3-Trifluoromethylbenzoic anhydride is 25753-15-5.
What is the molecular formula of 3-Trifluoromethylbenzoic anhydride?
The molecular formula of 3-Trifluoromethylbenzoic anhydride is C16H8F6O3.
What is the molecular weight of 3-Trifluoromethylbenzoic anhydride?
The molecular weight of 3-Trifluoromethylbenzoic anhydride is 362.04 g/mol.
Where can I buy 3-Trifluoromethylbenzoic anhydride?
You can request a quote for 3-Trifluoromethylbenzoic anhydride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Trifluoromethylbenzoic anhydride?
Yes, KEHONG BIO provides custom synthesis services for 3-Trifluoromethylbenzoic anhydride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.