2-Methoxycarbonyl-4-methylthiophene-3-diazonium tetrafluoroborate

• Catalog: OFC1709018336
• CAS: 1709018-33-6
• Category: Fluorinated Thiophenes
• MDL Number: MFCD00816914

• IUPAC Name: 2-methoxycarbonyl-4-methylthiophene-3-diazonium;tetrafluoroborate
• InChI: InChI=1S/C7H7N2O2S.BF4/c1-4-3-12-6(5(4)9-8)7(10)11-2;2-1(3,4)5/h3H,1-2H3;/q+1;-1
• InChI Key: SVGWOAYWJOKQNF-UHFFFAOYSA-N
• Isomeric SMILES: [B-](F)(F)(F)F.CC1=CSC(=C1[N+]#N)C(=O)OC

• Molecular Formula: C7H7BF4N2O2S
• Molecular Weight: 270.01

• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 9
• Rotatable Bond Count: 2
• Exact Mass: 270.0257415 g/mol
• Monoisotopic Mass: 270.0257415 g/mol
• Topological Polar Surface Area: 82.7Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 254