2-(2-Bromophenyl)-3-methyloxazolidine
Basic information
- CAS
71758-42-4- Standard SMILES
CN1CCOC1c1ccccc1Br- InChIKey
HDQISVZIHFZWEY-UHFFFAOYSA-N- Molecular formula
- C10H12BrNO
- Average molar mass
- 242.11 g/mol
- Monoisotopic mass
- 241.01023
Names & identifiers
- Preferred name
- 2-(2-Bromophenyl)-3-methyloxazolidine
- IUPAC
- 2-(2-bromophenyl)-3-methyl-1,3-oxazolidine
- English name
- 2-(2-Bromophenyl)-3-methyloxazolidine
- Molecular formula
- C10H12BrNO
- Molecular weight
- 242.11
Names & synonyms
71758-42-42-(2-BROMOPHENYL)-3-METHYLOXAZOLIDINE2-(2-bromophenyl)-3-methyl-1,3-oxazolidineSCHEMBL11461916DTXSID80521026DB-0820792-(o-Bromophenyl)-3-methyloxazolidineOxazolidine, 2-(2-bromophenyl)-3-methyl-
Database identifiers
- CAS
71758-42-4- PubChem CID
- 13137336
- DTXSID
DTXSID80521026- Nikkaji
- J24.441D
Properties
Computed structural properties
- XLogP
- 2.2
- Topological polar surface area
- 12.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 176
Physicochemical properties
- Boiling point
- 273.6 · 273.6±40.0 °C(Predicted)
- Density
- 1.414 · 1.414±0.06 g/cm3(Predicted)
- pka
- 6.28 · 6.28±0.40(Predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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