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6-chloro-3-[2-(trifluoromethyl)benzoyl]-1H-indole

6-chloro-3-[2-(trifluoromethyl)benzoyl]-1H-indole

Formula: C16H9ClF3NO

SMILES: FC(F)(F)C1=C(C=CC=C1)C(=O)C1=CNC2=CC(Cl)=CC=C12

IUPAC: 6-chloro-3-[2-(trifluoromethyl)benzoyl]-1H-indole

InChI: InChI=1S/C16H9ClF3NO/c17-9-5-6-10-12(8-21-14(10)7-9)15(22)11-3-1-2-4-13(11)16(18,19)20/h1-8,21H

Composition: C (59.37%), H (2.80%), Cl (10.95%), F (17.61%), N (4.33%), O (4.94%)

Molar Mass: 323.7

Atom Count: 31

Heavy Atom Count: 22

Properties
Properties
Common Names N/A
Aromatic Ring Count 3
Asymmetric Atom Count 0
Exact Mass 323.0324761
Formal Charge 0
FSP3 0.06
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey PGIHMQGRWZECLU-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity 78.5
Topological Polar Surface Area 32.86
Polarizability 30.05
Ring Count 3
Rotatable Bond Count 3

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Struchem co.,ltd
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Purity LeadTime Formula PacketSize UnitPrice
95% <5 Days C16H9ClF3NO $554.00-$1,781.00$554.00$1,241.00$1,781.00
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