6,7-difluoro-1H-indole-2-carboxylic acid

6,7-difluoro-1H-indole-2-carboxylic acid

CAS: 247564-68-7

Formula: C9H5F2NO2

SMILES: OC(=O)C1=CC2=CC=C(F)C(F)=C2N1

IUPAC: 6,7-difluoro-1H-indole-2-carboxylic acid

InChI: InChI=1S/C9H5F2NO2/c10-5-2-1-4-3-6(9(13)14)12-8(4)7(5)11/h1-3,12H,(H,13,14)

Composition: C (54.83%), H (2.56%), F (19.27%), N (7.11%), O (16.23%)

Molar Mass: 197.141

Atom Count: 19

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	197.028834731
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	2
InChIKey	NFIPAJWNYDCIRO-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	44.71
Topological Polar Surface Area	53.09
Polarizability	17.31
Ring Count	2
Rotatable Bond Count	1

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