![2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one structure](/static/products/899/899388-62-6.webp)
2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one
TL;DR: 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one (CAS 899388-62-6) is a chemical compound with molecular formula C15H10F3NO3 and molecular weight 309.06128 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-1,3-benzoxazin-4-one
Also Known As: 2-(4-(trifluoromethoxy)phenyl)-2H-benzo[e][1,3]oxazin-4(3H)-one, 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-1,3-benzoxazin-4-one, 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one
Technical Specifications
| Molecular Formula | C15H10F3NO3 |
| Molecular Weight | 309.06128 g/mol |
| XLogP | 3.8 |
| Topological Polar Surface Area (TPSA) | 47.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 309.06128 Da |
| Heavy Atoms | 22 |
| Complexity | 407.0 |
| SMILES | C1=CC=C2C(=C1)C(=O)NC(O2)C3=CC=C(C=C3)OC(F)(F)F |
| InChIKey | GFTREKDAGOGPTO-UHFFFAOYSA-N |
Chemical Property Profile of 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one
Property Insights of 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one
The XLogP value of 3.8 indicates that 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 47.6 Ų, 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one 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 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one?
The CAS number of 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one is 899388-62-6.
What is the molecular formula of 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one?
The molecular formula of 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one is C15H10F3NO3.
What is the molecular weight of 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one?
The molecular weight of 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one is 309.06128 g/mol.
Where can I buy 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one?
You can request a quote for 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one?
Yes, CoreyChem provides custom synthesis services for 2-[4-(trifluoromethoxy)phenyl]-2,3-dihydro-4H-1,3-benzoxazin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.