5-[2-Bromo-1-(prop-2-en-1-yloxy)propyl]-1,3-benzodioxole
Basic information
- CAS
7152-60-5- Standard SMILES
C=CCOC(c1ccc2c(c1)OCO2)C(C)Br- InChIKey
KKHSRYAUYKCYOP-UHFFFAOYSA-N- Molecular formula
- C13H15BrO3
- Average molar mass
- 299.16 g/mol
- Monoisotopic mass
- 298.02046
Names & identifiers
- Preferred name
- 5-[2-Bromo-1-(prop-2-en-1-yloxy)propyl]-1,3-benzodioxole
- IUPAC
- 5-(2-bromo-1-prop-2-enoxypropyl)-1,3-benzodioxole
Names & synonyms
7152-60-55-[2-bromo-1-(prop-2-en-1-yloxy)propyl]-1,3-benzodioxoleNSC24723DTXSID60282143NSC-247235-{2-Bromo-1-[(prop-2-en-1-yl)oxy]propyl}-2H-1,3-benzodioxole
Database identifiers
- CAS
7152-60-5- PubChem CID
- 230144
- DTXSID
DTXSID60282143
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 259
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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