(S)-1-(4-Methyl-4,5-dihydrooxazol-2-yl)ethanone
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Basic information
- CAS
185444-99-9- Standard SMILES
CC(=O)C1=N[C@@H](C)CO1- InChIKey
QJSATJREYUEMPC-BYPYZUCNSA-N- Molecular formula
- C6H9NO2
- Average molar mass
- 127.14 g/mol
Names & identifiers
- Preferred name
- (S)-1-(4-Methyl-4,5-dihydrooxazol-2-yl)ethanone
- IUPAC
- 1-[(4S)-4-methyl-4,5-dihydro-1,3-oxazol-2-yl]ethanone
- English name
- Ethanone, 1-(4,5-dihydro-4-methyl-2-oxazolyl)-, (S)- (9CI)
- Molecular formula
- C6H9NO2
- Molecular weight
- 127.14116
Names & synonyms
(S)-1-(4-Methyl-4,5-dihydrooxazol-2-yl)ethanone185444-99-9Ethanone, 1-(4,5-dihydro-4-methyl-2-oxazolyl)-, (S)- (9CI)
Database identifiers
- CAS
185444-99-9
Properties
Computed structural propertiesFilling in
- XLogP
- 0.1
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 162
Related reactions
0 records
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Compound notes
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