2-Methyl-1,3-thiazole-4-carbaldehyde

C₅H₅NOSCAS 20949-84-2127.16 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₅H₅NOS
Molar mass: 127.16 g/mol
Exact mass: 127.0092 Da
logP: 1.26Crippen estimate
Polar surface area: 30.0 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Identifiers

CAS number

20949-84-2

SMILES

CC1=NC(=CS1)C=O

InChIKey

AEHWVNPVEUVPMT-UHFFFAOYSA-N

InChI

InChI=1S/C5H5NOS/c1-4-6-5(2-7)3-8-4/h2-3H,1H3

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Names and synonyms

1 names

4-Formyl-2-methylthiazole

Work with 2-Methyl-1,3-thiazole-4-carbaldehyde

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

2,6-Diformylpyridine5431-44-738 % similar 5-Methyl-2-thiophenecarboxaldehyde13679-70-433 % similar 2-(Methylthio)-4-pyrimidinecarboxaldehyde1074-68-632 % similar 6-Methoxy-2-pyridinecarboxaldehyde54221-96-432 % similar 3-Methyl-2-thiophenecarboxaldehyde5834-16-232 % similar 6-Bromo-2-pyridinecarboxaldehyde34160-40-231 % similar 2,5-Thiophenedicarboxaldehyde932-95-631 % similar 2-Quinolinecarboxaldehyde5470-96-231 % 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-Acetylthiazole24295-03-2 Thiophene-2-aldoxime29683-84-9 2-Thiophenecarboxamide5813-89-8 4-Methyl-5-thiazolecarboxaldehyde82294-70-0

Elsewhere

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