chempirical

7-Fluoro-1H-indole

C8H6FNCAS 387-44-0135.14 g/mol

Open in Covalent MOL file
FHN
Aryl halide

Properties

Molecular formula
C8H6FN
Molar mass
135.14 g/mol
Exact mass
135.0484 Da
Melting point
61–62 °C
logP
2.31Crippen estimate
Polar surface area
15.8 Ų
H-bond donors / acceptors
1 / 0
Rotatable bonds
0

Identifiers

CAS number
387-44-0
SMILES
Fc1cccc2cc[nH]c12
InChIKey
XONKJZDHGCMRRF-UHFFFAOYSA-N
InChI
InChI=1S/C8H6FN/c9-7-3-1-2-6-4-5-10-8(6)7/h1-5,10H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

3 names
  • 1H-Indole, 7-fluoro-
  • Indole, 7-fluoro-
  • 7-Fluoroindole

Work with 7-Fluoro-1H-indole

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

7-Chloroindole53924-05-354 % similar 7-Methylindole933-67-552 % similar 1H-Indole-7-methanol1074-87-947 % similar Indole-7-carboxaldehyde1074-88-047 % similar 7-Methoxyindole3189-22-847 % similar 5,6-Difluoro-1H-indole169674-01-543 % similar 1H-Indole-7-carboxylic acid1670-83-343 % similar 1-Fluoronaphthalene321-38-043 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

4-Fluoro-2-methylbenzonitrile147754-12-9 4-Fluoro-3-methylbenzonitrile185147-08-4 2-Fluorobenzeneacetonitrile326-62-5 5-Fluoroindole399-52-0 4-Fluorobenzeneacetonitrile459-22-3 3-Fluorobenzeneacetonitrile501-00-8

Elsewhere

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