Basic information
- CAS
104502-50-3- Standard SMILES
CC1=C(Br)C(=O)OC1(C)CN1CCOCC1- InChIKey
MXWUYBSUZOJYBE-UHFFFAOYSA-N- Molecular formula
- C11H16BrNO3
- Average molar mass
- 290.15 g/mol
- Monoisotopic mass
- 289.03136
Names & identifiers
- Preferred name
- 2(5H)-Furanone, 3-bromo-4,5-dimethyl-5-(4-morpholinylmethyl)-
- IUPAC
- 3-bromo-4,5-dimethyl-5-(morpholin-4-ylmethyl)furan-2-one
Names & synonyms
BRN 4689398104502-50-33-Bromo-4,5-dimethyl-5-(4-morpholinylmethyl)-2(5H)-furanone2(5H)-FURANONE, 3-BROMO-4,5-DIMETHYL-5-(4-MORPHOLINYLMETHYL)-RefChem:241759DTXSID509090193-Bromo-4,5-dimethyl-5-[(morpholin-4-yl)methyl]furan-2(5H)-one
Database identifiers
- CAS
104502-50-3- PubChem CID
- 59863
- DTXSID
DTXSID50909019
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 38.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 336
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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