2-(4-Chlorophenyl)-1H-indole

C₁₄H₁₀ClNCAS 1211-35-4227.69 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₄H₁₀ClN
Molar mass: 227.69 g/mol
Exact mass: 227.0502 Da
logP: 4.49Crippen estimate
Polar surface area: 15.8 Å²
H-bond donors / acceptors: 1 / 0
Rotatable bonds: 1

Identifiers

CAS number

1211-35-4

SMILES

C1=CC=C2C(=C1)C=C(N2)C3=CC=C(C=C3)Cl

InChIKey

KDNXKQSAAZNUCK-UHFFFAOYSA-N

InChI

InChI=1S/C14H10ClN/c15-12-7-5-10(6-8-12)14-9-11-3-1-2-4-13(11)16-14/h1-9,16H

Weigh it out

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

Names and synonyms

1 names

2-(4-Chlorophenyl)indole

Work with 2-(4-Chlorophenyl)-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

4-Chlorobiphenyl2051-62-945 % similar 2-Chloronaphthalene91-58-742 % similar 4,4′-Dichlorobiphenyl2050-68-241 % similar 2-Chloroanthracene17135-78-341 % similar 4-(4-Chlorophenyl)-2-thiazolamine2103-99-339 % similar 2-(1,1-Dimethylethyl)-1H-indole1805-65-839 % similar 2-Aminoquinoline580-22-338 % similar 5-Chloro-2-methyl-1H-indole1075-35-038 % similar

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

Elsewhere

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