Basic information
- CAS
18775-39-8- Standard SMILES
CCc1cc(Br)cc2cc(C(C)=O)oc12- InChIKey
PPNZFWQOMJVVJT-UHFFFAOYSA-N- Molecular formula
- C12H11BrO2
- Average molar mass
- 267.12 g/mol
- Monoisotopic mass
- 265.99424
Names & identifiers
- Preferred name
- 1-(5-Bromo-7-ethyl-2-benzofuryl)ethan-1-one
- IUPAC
- 1-(5-bromo-7-ethyl-1-benzofuran-2-yl)ethanone
- English name
- 1-(5-bromo-7-ethyl-2-benzofuryl)ethan-1-one
- Molecular formula
- C12H11BrO2
- Molecular weight
- 267.12
Names & synonyms
18775-39-81-(5-Bromo-7-ethyl-2-benzofuryl)ethan-1-one1-(5-Bromo-7-ethylbenzofuran-2-yl)ethanone1-(5-bromo-7-ethyl-1-benzofuran-2-yl)ethanoneEINECS 242-562-11-(5-Bromo-7-ethyl-1-benzofuran-2-yl)ethan-1-oneDTXSID909402492-acetyl-5-bromo-7-ethylbenzofuranmethyl 5-bromo-7-ethylbenzofuranyl ketoneNS00048144Ethanone, 1-(5-bromo-7-ethyl-2-benzofuranyl)-
Database identifiers
- CAS
18775-39-8- PubChem CID
- 87785
- DTXSID
DTXSID90940249- EC Number
- 242-562-1
- Nikkaji
- J222.299J
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 30.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 254
Physicochemical properties
- Melting point
- 69 · 69-70 °C
- Boiling point
- 145 · 145-155 °C(Press: 1 Torr)
- Density
- 1.429 · 1.429±0.06 g/cm3(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers1 total
HONEST JOY HOLDINGS LIMITED[email protected]
Related reactions
2 records
Compound notes
Loading…