3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione
TL;DR: 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione (CAS 712346-38-8) is a chemical compound with molecular formula C17H16F3NO3 and molecular weight 339.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione
Also Known As: 3-anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione, 6,6-dimethyl-3-(phenylamino)-3-(trifluoromethyl)-3,5,6,7-tetrahydro-1-benzofuran-2,4-dione, 6,6-dimethyl-3-(phenylamino)-3-(trifluoromethyl)-6,7-dihydrobenzofuran-2,4(3H,5H)-dione
| Molecular Formula | C17H16F3NO3 |
|---|---|
| Molecular Weight | 339.11 g/mol |
| LogP | 3.5996 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 339.10822 |
| Heavy Atoms | 24 |
| Complexity | 737.1977 |
Chemical Identifiers
| CAS Number | 712346-38-8 |
|---|---|
| SMILES | CC1(CC2=C(C(=O)C1)C(C(=O)O2)(C(F)(F)F)NC3=CC=CC=C3)C |
Product Overview
3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione (CAS 712346-38-8), with molecular formula C17H16F3NO3 and molecular weight 339.11 g/mol. IUPAC: 3-anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione.
Chemical Property Profile of 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione
Property Insights of 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione
The XLogP value of 3.5996 indicates that 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione has 1 hydrogen bond donor(s) and 4 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-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione?
The CAS number of 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione is 712346-38-8.
What is the molecular formula of 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione?
The molecular formula of 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione is C17H16F3NO3.
What is the molecular weight of 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione?
The molecular weight of 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione is 339.11 g/mol.
Where can I buy 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione?
You can request a quote for 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione?
Yes, KEHONG BIO provides custom synthesis services for 3-Anilino-6,6-dimethyl-3-(trifluoromethyl)-5,7-dihydro-1-benzofuran-2,4-dione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.