2,6-Difluorobenzotrichloride
TL;DR: 2,6-Difluorobenzotrichloride (CAS 93632-85-0) is a chemical compound with molecular formula C7H3Cl3F2 and molecular weight 229.93 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-difluoro-2-(trichloromethyl)benzene
Also Known As: 2,6-Difluorobenzotrichloride, 1,3-difluoro-2-(trichloromethyl)benzene, Benzene, 1,3-difluoro-2-(trichloromethyl)-, 1,3-Difluoro-2-trichloromethylbenzene, 651-870-9
| Molecular Formula | C7H3Cl3F2 |
|---|---|
| Molecular Weight | 229.93 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 0.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 229.92683 |
| Heavy Atoms | 12 |
| Complexity | 147.0 |
Chemical Identifiers
| CAS Number | 93632-85-0 |
|---|---|
| SMILES | C1=CC(=C(C(=C1)F)C(Cl)(Cl)Cl)F |
| InChIKey | YGARWFJIRLUUNE-UHFFFAOYSA-N |
Product Overview
2,6-Difluorobenzotrichloride (CAS 93632-85-0), with molecular formula C7H3Cl3F2 and molecular weight 229.93 g/mol. IUPAC: 1,3-difluoro-2-(trichloromethyl)benzene.
Chemical Property Profile of 2,6-Difluorobenzotrichloride
Property Insights of 2,6-Difluorobenzotrichloride
The XLogP value of 3.7 indicates that 2,6-Difluorobenzotrichloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 0.0 Ų, 2,6-Difluorobenzotrichloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,6-Difluorobenzotrichloride 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
Frequently Asked Questions
What is the CAS number of 2,6-Difluorobenzotrichloride?
The CAS number of 2,6-Difluorobenzotrichloride is 93632-85-0.
What is the molecular formula of 2,6-Difluorobenzotrichloride?
The molecular formula of 2,6-Difluorobenzotrichloride is C7H3Cl3F2.
What is the molecular weight of 2,6-Difluorobenzotrichloride?
The molecular weight of 2,6-Difluorobenzotrichloride is 229.93 g/mol.
Where can I buy 2,6-Difluorobenzotrichloride?
You can request a quote for 2,6-Difluorobenzotrichloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,6-Difluorobenzotrichloride?
Yes, KEHONG BIO provides custom synthesis services for 2,6-Difluorobenzotrichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.