Basic information
- Standard SMILES
C[C@@]1(CBr)OC(=O)[C@H]2CCCN2C1=O- InChIKey
YCJBMGQHPACRHJ-MUWHJKNJSA-N- Molecular formula
- C9H12BrNO3
- Average molar mass
- 262.1 g/mol
Names & identifiers
- Preferred name
- (3R,8aR)-3-Bromomethyl-3-methyltetrahydropyrrolo[2,1-c][1,4]oxazine-1,4-dione
- IUPAC
- (3R,8aR)-3-(bromomethyl)-3-methyl-6,7,8,8a-tetrahydropyrrolo[2,1-c][1,4]oxazine-1,4-dione
Names & synonyms
106138-80-1SCHEMBL110560YCJBMGQHPACRHJ-MUWHJKNJSA-N(3R,8aR)-3-(bromomethyl)-3-methyltetrahydro-1H-pyrrolo[2,1-c][1,4]oxazine-1,4(3H)-dione(3r,8ar)-3-bromomethyl-3-methyl-tetrahydro-pyrrolo[2,1-c][1,4]oxazine-1,4-dione(3R,8aR)-3-Bromomethyl-3-methyltetrahydropyrrolo[2,1-c][1,4]oxazine-1,4-dione
Database identifiers
- PubChem CID
- 11615879
- Nikkaji
- J2.117.600A
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 46.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 294
Related reactions
1 records
Linked notes
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