Thiazole, 5-acetyl-4-methyl-2-(2-(5-nitrofuryl)vinyl)-
Basic information
- CAS
37566-47-5- Standard SMILES
CC(=O)c1sc(/C=C/c2ccc([N+](=O)[O-])o2)nc1C- InChIKey
JLMDCRSVWZKFHH-HWKANZROSA-N- Molecular formula
- C12H10N2O4S
- Average molar mass
- 278.29 g/mol
- Monoisotopic mass
- 278.03612798
Names & identifiers
- Preferred name
- Thiazole, 5-acetyl-4-methyl-2-(2-(5-nitrofuryl)vinyl)-
- IUPAC
- 1-[4-methyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-1,3-thiazol-5-yl]ethanone
Names & synonyms
Thiazole, 5-acetyl-4-methyl-2-(2-(5-nitrofuryl)vinyl)-37566-47-5RefChem:1099840BRN 06226845-Acetyl-4-methyl-2-(2-(5-nitrofuryl)vinyl)thiazoleEthanone, 1-(4-methyl-2-(2-(5-nitro-2-furanyl)ethenyl)-5-thiazolyl)-
Database identifiers
- CAS
37566-47-5- PubChem CID
- 6445583
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 117 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 396
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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