2-Phenylindole-3-carboxaldehyde

C₁₅H₁₁NOCAS 25365-71-3221.26 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₅H₁₁NO
Molar mass: 221.26 g/mol
Exact mass: 221.0841 Da
logP: 3.65Crippen estimate
Polar surface area: 32.9 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 2

Identifiers

CAS number

25365-71-3

SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3N2)C=O

InChIKey

IFIFXODAHZPTEY-UHFFFAOYSA-N

InChI

InChI=1S/C15H11NO/c17-10-13-12-8-4-5-9-14(12)16-15(13)11-6-2-1-3-7-11/h1-10,16H

Weigh it out

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

Work with 2-Phenylindole-3-carboxaldehyde

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

2-Methylindole-3-carboxaldehyde5416-80-857 % similar 9,10-Anthracenedicarboxaldehyde7044-91-947 % similar 2-Phenylindole-3-acetonitrile27005-52-345 % similar 3-Phenyl-1H-pyrazole-4-carbaldehyde26033-20-541 % similar 3-Phenyl-9H-carbazole103012-26-641 % similar Indole-3-carbaldehyde487-89-841 % similar 1-Methyl-2-phenyl-1H-indole-3-carboxaldehyde1757-72-840 % similar Anthracene-9-carbaldehyde642-31-940 % similar

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

Same formula

3-Amino-2-phenyl-1H-inden-1-one1947-47-3 2,5-Diphenyloxazole92-71-7

Elsewhere

PubChem CAS Common Chemistry NIST WebBook