Basic information
- CAS
94773-39-4- Standard SMILES
CC(C)(C)OC1C=CC(=O)N1- InChIKey
TZQVKHJTLZMXFV-UHFFFAOYSA-N- Molecular formula
- C8H13NO2
- Average molar mass
- 155.19 g/mol
- Monoisotopic mass
- 155.09462866
Names & identifiers
- Preferred name
- 5-tert-Butoxy-1,5-dihydro-2H-pyrrol-2-one
- IUPAC
- 2-[(2-methylpropan-2-yl)oxy]-1,2-dihydropyrrol-5-one
Names & synonyms
94773-39-45-tert-Butoxy-1,5-dihydro-2H-pyrrol-2-oneDTXSID50536965
Database identifiers
- CAS
94773-39-4- PubChem CID
- 13328443
- DTXSID
DTXSID50536965
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 191
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…