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3-bromo-7-(trifluoromethyl)-2H-indazole

3-bromo-7-(trifluoromethyl)-2H-indazole

CAS: 885693-99-2

Formula: C8H4BrF3N2

SMILES: FC(F)(F)C1=CC=CC2=C(Br)NN=C12

IUPAC: 3-bromo-7-(trifluoromethyl)-2H-indazole

InChI: InChI=1S/C8H4BrF3N2/c9-7-4-2-1-3-5(8(10,11)12)6(4)13-14-7/h1-3H,(H,13,14)

Composition: C (36.26%), H (1.52%), Br (30.15%), F (21.50%), N (10.57%)

Molar Mass: 265.033

Atom Count: 18

Heavy Atom Count: 14

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 263.950996
Formal Charge 0
FSP3 0.12
Hetero Ring Count 1
Hydrogen Bond Acceptor Count 1
Hydrogen Bond Donor Count 1
InChIKey JRZSKVKGURAWFH-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 49.2
Topological Polar Surface Area 28.68
Polarizability 18.87
Ring Count 2
Rotatable Bond Count 1

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95% <5 Days 885693-99-2 $1,720.00-$4,595.00$1,720.00$4,595.00
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