1-(1-Bromo-2-methylpropan-2-yl)-4-ethoxybenzene
Basic information
- CAS
120998-59-6- Standard SMILES
CCOc1ccc(C(C)(C)CBr)cc1- InChIKey
FYTADQPUXAQZFW-UHFFFAOYSA-N- Molecular formula
- C12H17BrO
- Average molar mass
- 257.17 g/mol
- Monoisotopic mass
- 256.04628
Names & identifiers
- Preferred name
- 1-(1-Bromo-2-methylpropan-2-yl)-4-ethoxybenzene
- IUPAC
- 1-(1-bromo-2-methylpropan-2-yl)-4-ethoxybenzene
Names & synonyms
1-(1-Bromo-2-methylpropan-2-yl)-4-ethoxybenzene120998-59-6DTXSID10560483EN300-1911840
Database identifiers
- CAS
120998-59-6- PubChem CID
- 14453062
- DTXSID
DTXSID10560483
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 160
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Compound notes
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