2,4-Dichloro-5-methylbenzotrifluoride
TL;DR: 2,4-Dichloro-5-methylbenzotrifluoride (CAS 115571-61-4) is a chemical compound with molecular formula C8H5Cl2F3 and molecular weight 227.97205 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,5-dichloro-2-methyl-4-(trifluoromethyl)benzene
Also Known As: 2,4-Dichloro-5-methylbenzotrifluoride, 1,5-dichloro-2-methyl-4-(trifluoromethyl)benzene, CI Basic Red 9 HCl, 2,4-Dichloro-5-trifluoromethyltoluene, Benzene, 1,5-dichloro-2-methyl-4-(trifluoromethyl)-
Technical Specifications
| Molecular Formula | C8H5Cl2F3 |
| Molecular Weight | 227.97205 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 227.97205 Da |
| Heavy Atoms | 13 |
| Complexity | 181.0 |
| SMILES | CC1=CC(=C(C=C1Cl)Cl)C(F)(F)F |
| InChIKey | IEODOJMCKLXBMU-UHFFFAOYSA-N |
Chemical Property Profile of 2,4-Dichloro-5-methylbenzotrifluoride
Property Insights of 2,4-Dichloro-5-methylbenzotrifluoride
The XLogP value of 4.4 indicates that 2,4-Dichloro-5-methylbenzotrifluoride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,4-Dichloro-5-methylbenzotrifluoride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,4-Dichloro-5-methylbenzotrifluoride has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,4-Dichloro-5-methylbenzotrifluoride?
The CAS number of 2,4-Dichloro-5-methylbenzotrifluoride is 115571-61-4.
What is the molecular formula of 2,4-Dichloro-5-methylbenzotrifluoride?
The molecular formula of 2,4-Dichloro-5-methylbenzotrifluoride is C8H5Cl2F3.
What is the molecular weight of 2,4-Dichloro-5-methylbenzotrifluoride?
The molecular weight of 2,4-Dichloro-5-methylbenzotrifluoride is 227.97205 g/mol.
Where can I buy 2,4-Dichloro-5-methylbenzotrifluoride?
You can request a quote for 2,4-Dichloro-5-methylbenzotrifluoride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,4-Dichloro-5-methylbenzotrifluoride?
Yes, CoreyChem provides custom synthesis services for 2,4-Dichloro-5-methylbenzotrifluoride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.