Basic information
- CAS
87618-86-8- Standard SMILES
O=CC1=NO[C@H]2C=CC[C@H]2C1- InChIKey
GQFOEQWMIPIGDX-XPUUQOCRSA-N- Molecular formula
- C8H9NO2
- Average molar mass
- 151.16 g/mol
Names & identifiers
- Preferred name
- (4aS,7aR)-4,4a,5,7a-tetrahydrocyclopenta[e]oxazine-3-carbaldehyde
- IUPAC
- (4aS,7aR)-4,4a,5,7a-tetrahydrocyclopenta[e]oxazine-3-carbaldehyde
- English name
- Cyclopent[e]-1,2-oxazine-3-carboxaldehyde, 4,4a,5,7a-tetrahydro-, cis- (9CI)
- Molecular formula
- C8H9NO2
- Molecular weight
- 151.16256
Names & synonyms
Cyclopent[e]-1,2-oxazine-3-carboxaldehyde, 4,4a,5,7a-tetrahydro-, cis- (9CI)
Database identifiers
- CAS
87618-86-8
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 38.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 232
Chemistry & industry
Suppliers1 total
CHEMSTEP[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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