Basic information
- CAS
16602-27-0- Standard SMILES
C=Cc1cc(Br)ccc1OC(C)C- InChIKey
ALZZHCKOFMJWES-UHFFFAOYSA-N- Molecular formula
- C11H13BrO
- Average molar mass
- 241.12 g/mol
- Monoisotopic mass
- 240.01498
Names & identifiers
- Preferred name
- 4-Bromo-1-isopropoxy-2-vinylbenzene
- IUPAC
- 4-bromo-2-ethenyl-1-propan-2-yloxybenzene
Names & synonyms
16602-27-04-bromo-1-isopropoxy-2-vinylbenzene4-bromo-2-ethenyl-1-propan-2-yloxybenzeneBenzene, 4-bromo-2-ethenyl-1-(1-methylethoxy)-4-bromo-2-ethenyl-1-(propan-2-yloxy)benzene4-Bromo-1-isopropoxy-2-vinyl-benzeneSCHEMBL314775SCHEMBL16955519DTXSID20501903ALZZHCKOFMJWES-UHFFFAOYSA-NMFCD32877931DB-167048
Show more names
4-Bromo-2-ethenyl-1-[(propan-2-yl)oxy]benzeneA1-32932
Database identifiers
- CAS
16602-27-0- PubChem CID
- 12542425
- DTXSID
DTXSID20501903- Nikkaji
- J1.334.256C
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 167
Related reactions
35 records
Compound notes
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