1-phenyl-1H-imidazole; trifluoromethanesulfonic acid

1-phenyl-1H-imidazole; trifluoromethanesulfonic acid

CAS: 361447-81-6

Formula: C10H9F3N2O3S

SMILES: OS(=O)(=O)C(F)(F)F.C1=CN(C=N1)C1=CC=CC=C1

IUPAC: 1-phenyl-1H-imidazole; trifluoromethanesulfonic acid

InChI: InChI=1S/C9H8N2.CHF3O3S/c1-2-4-9(5-3-1)11-7-6-10-8-11;2-1(3,4)8(5,6)7/h1-8H;(H,5,6,7)

Composition: C (40.82%), H (3.08%), F (19.37%), N (9.52%), O (16.31%), S (10.90%)

Molar Mass: 294.25

Atom Count: 28

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	294.028597821
Formal Charge	0
FSP3	0.1
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	FKGZYFHAFBWWPJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	54.01
Topological Polar Surface Area	17.82
Polarizability	17.45
Ring Count	2
Rotatable Bond Count	2

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