6-(trifluoromethyl)-1H-indazole-3-carbaldehyde

6-(trifluoromethyl)-1H-indazole-3-carbaldehyde

CAS: 885271-90-9

Formula: C9H5F3N2O

SMILES: FC(F)(F)C1=CC=C2C(NN=C2C=O)=C1

IUPAC: 6-(trifluoromethyl)-1H-indazole-3-carbaldehyde

InChI: InChI=1S/C9H5F3N2O/c10-9(11,12)5-1-2-6-7(3-5)13-14-8(6)4-15/h1-4H,(H,13,14)

Composition: C (50.48%), H (2.35%), F (26.61%), N (13.08%), O (7.47%)

Molar Mass: 214.147

Atom Count: 20

Heavy Atom Count: 15

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	214.035397278
Formal Charge	0
FSP3	0.11
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	KWWVGVOHIZTSLE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	48.25
Topological Polar Surface Area	45.75
Polarizability	17.69
Ring Count	2
Rotatable Bond Count	2

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