Thiophene-2-aldoxime

C5H5NOSCAS 29683-84-9127.16 g/mol

Open in Covalent MOL file
HONS
Oxime

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 Ų
H-bond donors / acceptors
1 / 3
Rotatable bonds
1

Hazards

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

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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

2-Vinylthiophene1918-82-746 % similar Thiophene-2-carboxaldehyde98-03-346 % similar Benzaldehyde oxime932-90-143 % similar 3-(2-Thienyl)-2-propenoic acid1124-65-840 % similar 3-(2-Thienyl)acrylic acid15690-25-240 % similar 2,6-Dichlorobenzaldehyde oxime25185-95-939 % similar 2,6-Difluorobenzaldehyde oxime19064-16-538 % similar 2-Bromobenzaldoxime34158-72-038 % 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 4-Cyano-3-tetrahydrothiophenone16563-14-7 2-Methyl-1,3-thiazole-4-carbaldehyde20949-84-2 2-Acetylthiazole24295-03-2 2-Thiophenecarboxamide5813-89-8 4-Methylthiazole-5-carboxaldehyde82294-70-0

Elsewhere

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