3-Isoxazolidinone, 2-propyl-
Basic information
- CAS
40784-16-5- Standard SMILES
CCCN1OCCC1=O- InChIKey
WOWQQULALBNEEM-UHFFFAOYSA-N- Molecular formula
- C6H11NO2
- Average molar mass
- 129.16 g/mol
- Monoisotopic mass
- 129.07897859
Names & identifiers
- Preferred name
- 3-Isoxazolidinone, 2-propyl-
- IUPAC
- 2-propyl-1,2-oxazolidin-3-one
Names & synonyms
3-ISOXAZOLIDINONE, 2-PROPYL-2-Propylisoxazolid-3(2H)-oneBRN 063669040784-16-5DTXSID90193773RefChem:280288DTXCID301162642-propyl-1,2-oxazolidin-3-oneSCHEMBL15055757
Database identifiers
- CAS
40784-16-5- PubChem CID
- 38676
- DTXSID
DTXSID90193773- Nikkaji
- J96.749A
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 114
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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