5-bromo-6-(trifluoromethyl)-1H-indole

5-bromo-6-(trifluoromethyl)-1H-indole

CAS: 1198475-24-9

Formula: C9H5BrF3N

SMILES: FC(F)(F)C1=C(Br)C=C2C=CNC2=C1

IUPAC: 5-bromo-6-(trifluoromethyl)-1H-indole

InChI: InChI=1S/C9H5BrF3N/c10-7-3-5-1-2-14-8(5)4-6(7)9(11,12)13/h1-4,14H

Composition: C (40.94%), H (1.91%), Br (30.26%), F (21.59%), N (5.30%)

Molar Mass: 264.045

Atom Count: 19

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	262.955747
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	0
Hydrogen Bond Donor Count	1
InChIKey	BANFNSUAJPLWMG-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.74
Topological Polar Surface Area	15.79
Polarizability	19.57
Ring Count	2
Rotatable Bond Count	1

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