3-(3-(Trifluoromethyl)-3H-diazirin-3-yl)-1H-indole

• Catalog: OFC2231676712
• CAS: 2231676-71-2
• Category: Fluorinated Indoles
• Synonyms: 3-[3-(trifluoromethyl)diazirin-3-yl]-1H-indole
• MDL Number: MFCD31621178

• IUPAC Name: 3-[3-(trifluoromethyl)diazirin-3-yl]-1H-indole
• InChI: InChI=1S/C10H6F3N3/c11-10(12,13)9(15-16-9)7-5-14-8-4-2-1-3-6(7)8/h1-5,14H
• InChI Key: ZNOCHACZLHAGST-UHFFFAOYSA-N
• Isomeric SMILES: C1=CC=C2C(=C1)C(=CN2)C3(N=N3)C(F)(F)F

• Molecular Formula: C10H6F3N3
• Molecular Weight: 225.17

• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 225.05138169 g/mol
• Monoisotopic Mass: 225.05138169 g/mol
• Topological Polar Surface Area: 40.5Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 320