(1S,7AR)-5-oxo-2,3,5,7a-tetrahydro-1H-pyrrolizine-1-carbaldehyde
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Basic information
- CAS
160724-85-6- Standard SMILES
O=C[C@H]1CCN2C(=O)C=C[C@H]12- InChIKey
DALSGABBFDNDEN-RNFRBKRXSA-N- Molecular formula
- C8H9NO2
- Average molar mass
- 151.16 g/mol
- Monoisotopic mass
- 151.06332853
Names & identifiers
- Preferred name
- (1S,7AR)-5-oxo-2,3,5,7a-tetrahydro-1H-pyrrolizine-1-carbaldehyde
- IUPAC
- (1S,8R)-5-oxo-1,2,3,8-tetrahydropyrrolizine-1-carbaldehyde
- English name
- 1H-Pyrrolizine-1-carboxaldehyde, 2,3,5,7a-tetrahydro-5-oxo-, (1S-cis)- (9CI)
- Molecular formula
- C8H9NO2
- Molecular weight
- 151.16
Names & synonyms
160724-85-6(1S,7AR)-5-oxo-2,3,5,7a-tetrahydro-1H-pyrrolizine-1-carbaldehyde1H-Pyrrolizine-1-carboxaldehyde, 2,3,5,7a-tetrahydro-5-oxo-, (1S-cis)- (9CI)
Database identifiers
- CAS
160724-85-6- PubChem CID
- 45083715
Properties
Computed structural propertiesFilling in
- XLogP
- -0.5
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 234
Related reactions
0 records
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Compound notes
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