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Basic information
- Standard SMILES
Brc1ccc(OCC2COC2)cc1- InChIKey
HWLGJUOAAXLXSW-UHFFFAOYSA-N- Molecular formula
- C10H11BrO2
- Average molar mass
- 243.1 g/mol
- Monoisotopic mass
- 241.99424
Names & identifiers
- Preferred name
- 3-((4-Bromophenoxy)methyl)oxetane
- IUPAC
- 3-[(4-bromophenoxy)methyl]oxetane
Names & synonyms
3-((4-Bromophenoxy)methyl)oxetane1393688-54-43-[(4-bromophenoxy)methyl]oxetaneSCHEMBL15301046HWLGJUOAAXLXSW-UHFFFAOYSA-NDB-122503
Database identifiers
- PubChem CID
- 60169428
Properties
Computed structural propertiesFilling in
- XLogP
- 2.5
- Topological polar surface area
- 18.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 151
Related reactions
4 records
Compound notes
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