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Basic information
- CAS
4693-19-0- Standard SMILES
CCCCCCCC(=O)c1cc(O)ccc1O- InChIKey
UVAFQENBAUNGJG-UHFFFAOYSA-N- Molecular formula
- C14H20O3
- Average molar mass
- 236.311 g/mol
- Monoisotopic mass
- 236.1412445
Names & identifiers
- Preferred name
- 1-Octanone, 1-(2,5-dihydroxyphenyl)-
- IUPAC
- 1-(2,5-Dihydroxyphenyl)octan-1-one
- English name
- 2',5'-dihydroxyoctanophenone
- Molecular formula
- C14H20O3
- Molecular weight
- 236.31
Names & synonyms
Einecs 225-152-72',5'-dihydroxyoctanophenone1-(2,5-Dihydroxyphenyl)-1-octanone1-Octanone, 1-(2,5-dihydroxyphenyl)-
Database identifiers
- CAS
4693-19-0- PubChem CID
- 78415
- DTXSID
DTXSID2063559- EC Number
- 225-152-7
- Nikkaji
- J297.891A
Properties
Physicochemical properties
- Melting point
- 84.5 · 84.5-86 °C
- Boiling point
- 393.5 · 393.5±27.0 °C(Predicted)
- Density
- 1.089 · 1.089±0.06 g/cm3(Predicted)
- pka
- 8.72 · 8.72±0.43(Predicted)
- EPA Substance Registry System
- 1 · 1-Octanone, 1-(2,5-dihydroxyphenyl)- (4693-19-0)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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