Thiazole, 5-acetyl-4-methyl-2-(2-(5-nitrofuryl)vinyl)-, O-acetyloxime
Basic information
- CAS
40236-84-8- Standard SMILES
CC(=O)O/N=C(/C)c1sc(/C=C/c2ccc([N+](=O)[O-])o2)nc1C- InChIKey
BTSCLWGSJKEMPB-IXGNKIAJSA-N- Molecular formula
- C14H13N3O5S
- Average molar mass
- 335.34 g/mol
- Monoisotopic mass
- 335.0575917
Names & identifiers
- Preferred name
- Thiazole, 5-acetyl-4-methyl-2-(2-(5-nitrofuryl)vinyl)-, O-acetyloxime
- IUPAC
- [(Z)-1-[4-methyl-2-[(E)-2-(5-nitrofuran-2-yl)ethenyl]-1,3-thiazol-5-yl]ethylideneamino] acetate
Names & synonyms
Thiazole, 5-acetyl-4-methyl-2-(2-(5-nitrofuryl)vinyl)-, O-acetyloxime40236-84-8RefChem:1099841BRN 0580967Ethanone, 1-(4-methyl-2-(2-(5-nitro-2-furanyl)ethenyl)-5-thiazolyl)-, O-acetyloxime5-Acetyl-4-methyl-2-(2-(5-nitrofuryl)vinyl)thiazole O-acetyloxime
Database identifiers
- CAS
40236-84-8- PubChem CID
- 6507933
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 139 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 519
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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