2-(3-Thienyl)-3-pyridinecarboxaldehyde

C₁₀H₇NOSCAS 885950-13-0189.23 g/mol

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Properties

Molecular formula: C₁₀H₇NOS
Molar mass: 189.23 g/mol
Exact mass: 189.0248 Da
logP: 2.62Crippen estimate
Polar surface area: 30.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

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

885950-13-0

SMILES

C1=CC(=C(N=C1)C2=CSC=C2)C=O

InChIKey

HAUWSNYPEZPXNX-UHFFFAOYSA-N

InChI

InChI=1S/C10H7NOS/c12-6-8-2-1-4-11-10(8)9-3-5-13-7-9/h1-7H

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Names and synonyms

1 names

2-(3-Thienyl)nicotinaldehyde

Work with 2-(3-Thienyl)-3-pyridinecarboxaldehyde

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-(4-Fluorophenyl)nicotinaldehyde885950-17-455 % similar Quinoline-5-carboxaldehyde22934-41-447 % similar 2-Bromonicotinaldehyde128071-75-046 % similar 4-(Thiophen-3-yl)benzaldehyde157730-74-046 % similar 2-Chloro-3-pyridinecarboxaldehyde36404-88-346 % similar 2-Fluoro-3-pyridinecarboxaldehyde36404-90-746 % similar 2-Methylpyridine-3-carbaldehyde60032-57-746 % similar 2-Amino-3-pyridinecarboxaldehyde7521-41-746 % similar

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

Same formula

5-(Pyridin-2-yl)thiophene-2-carbaldehyde132706-12-8

Elsewhere

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