5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine
TL;DR: 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine (CAS 146628-56-0) is a chemical compound with molecular formula C8H4Cl2F3NO2 and molecular weight 272.95712 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,6-dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine
Also Known As: IFLab1_004474, IDI1_010229, 5,6-dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine, F1023-0045, BRD-K50903418-001-02-1
Technical Specifications
| Molecular Formula | C8H4Cl2F3NO2 |
| Molecular Weight | 272.95712 g/mol |
| XLogP | 3.1 |
| Topological Polar Surface Area (TPSA) | 44.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 272.95712 Da |
| Heavy Atoms | 16 |
| Complexity | 271.0 |
| SMILES | C1=C2C(=CC(=C1Cl)Cl)OC(O2)(C(F)(F)F)N |
| InChIKey | XAGSXPKZLVNTID-UHFFFAOYSA-N |
Chemical Property Profile of 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine
Property Insights of 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine
The XLogP value of 3.1 indicates that 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 44.5 Ų, 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine?
The CAS number of 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine is 146628-56-0.
What is the molecular formula of 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine?
The molecular formula of 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine is C8H4Cl2F3NO2.
What is the molecular weight of 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine?
The molecular weight of 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine is 272.95712 g/mol.
Where can I buy 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine?
You can request a quote for 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine?
Yes, CoreyChem provides custom synthesis services for 5,6-Dichloro-2-(trifluoromethyl)-1,3-benzodioxol-2-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.