Thiophene-2-aldoxime

C₅H₅NOSCAS 29683-84-9127.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₅NOS
Molar mass: 127.16 g/mol
Exact mass: 127.0092 Da
Melting point: 128–129 °C
logP: 1.56Crippen estimate
Polar surface area: 32.6 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 1

Identifiers

CAS number

29683-84-9

SMILES

ON=Cc1cccs1

InChIKey

GASLBPLHYRZLLT-UHFFFAOYSA-N

InChI

InChI=1S/C5H5NOS/c7-6-4-5-2-1-3-8-5/h1-4,7H

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Names and synonyms

5 names

2-Thiophenecarboxaldehyde, oxime
2-Formylthiophene oxime
2-Thiophenealdehyde oxime
2-Thiophenecarboxaldoxime
NSC 110538

Work with Thiophene-2-aldoxime

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

Thiophene-2-carboxaldehyde98-03-346 % similar Benzaldehyde oxime932-90-143 % similar 3-(2-Thienyl)-2-propenoic acid1124-65-840 % similar (2E)-3-(2-Thienyl)-2-propenoic acid15690-25-240 % similar 2,6-Dichlorobenzaldehyde oxime25185-95-939 % similar 2,6-Difluorobenzaldehyde oxime19064-16-538 % similar 2-Bromobenzaldoxime34158-72-038 % similar Salicylaldoxime94-67-738 % similar

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

Same formula

2-Methylthiazole-5-carbaldehyde1003-60-7 2-Mercaptopyridine N-oxide1121-31-9 4-Methyl-1,3-thiazole-2-carbaldehyde13750-68-0 2-Acetylthiazole24295-03-2 2-Thiophenecarboxamide5813-89-8 4-Methyl-5-thiazolecarboxaldehyde82294-70-0

Elsewhere

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