(S)-3-Azido-4,4-dimethyldihydrofuran-2(3H)-one
Basic information
- CAS
157717-58-3- Standard SMILES
CC1(C)COC(=O)[C@H]1N=[N+]=[N-]- InChIKey
CUPAQOABYPHYPF-SCSAIBSYSA-N- Molecular formula
- C6H9N3O2
- Average molar mass
- 155.15 g/mol
Names & identifiers
- Preferred name
- (S)-3-Azido-4,4-dimethyldihydrofuran-2(3H)-one
- IUPAC
- (3S)-3-azido-4,4-dimethyloxolan-2-one
- English name
- (S)-3-Azido-4,4-dimethyldihydrofuran-2(3H)-one
- Molecular formula
- C6H9N3O2
- Molecular weight
- 155.16
Names & synonyms
(S)-3-AZIDO-4,4-DIMETHYLDIHYDROFURAN-2(3H)-ONE157717-58-3(3S)-3-AZIDO-4,4-DIMETHYLOXOLAN-2-ONESCHEMBL13566547CUPAQOABYPHYPF-SCSAIBSYSA-N(3S)-3-azido-4,4-dimethyl-tetrahydrofuran-2-one(3S)-3-azido-4,4-dimethyldihydrofuran-2(3H)-one
Database identifiers
- CAS
157717-58-3
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 40.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 230
Physicochemical properties
- HazardClass
- IRRITANT
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hazard_class
- IRRITANT
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Related reactions
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Compound notes
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