3-Iodo-7-azaindole

C₇H₅IN₂CAS 23616-57-1244.04 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₇H₅IN₂
Molar mass: 244.04 g/mol
Exact mass: 243.9497 Da
logP: 2.17Crippen estimate
Polar surface area: 28.7 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

23616-57-1

SMILES

C1=CC2=C(NC=C2I)N=C1

InChIKey

BTIANIFSBYIGPA-UHFFFAOYSA-N

InChI

InChI=1S/C7H5IN2/c8-6-4-10-7-5(6)2-1-3-9-7/h1-4H,(H,9,10)

Weigh it out

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

Work with 3-Iodo-7-azaindole

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

3-Methyl-1H-pyrrolo[2,3-b]pyridine5654-93-361 % similar 3-Bromo-7-azaindole74420-15-856 % similar 3-Chloro-7-azaindole80235-01-456 % similar 1H-Pyrrolo[2,3-b]pyridine-3-carbonitrile4414-89-551 % similar 7-Azaindole-3-carboxaldehyde4649-09-651 % similar 5-Bromo-3-iodo-1H-pyrrolo(2,3-b)pyridine757978-18-049 % similar 1H-Pyrrolo(2,3-b)pyridine-3-carboxylic acid156270-06-347 % similar 3-Nitro-7-azaindole23709-47-947 % similar

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

Same formula

6-Iodo-1H-indazole261953-36-0 4-Iodo-7-azaindole319474-34-5 5-Iodo-1H-indazole55919-82-9 3-Iodo-1H-indazole66607-27-0

Elsewhere

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