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Basic information
- CAS
956-23-0- Standard SMILES
CCC(=O)c1cc(OCC(O)CO)ccc1O- InChIKey
AQXAMCMWSDKKIG-UHFFFAOYSA-N- Molecular formula
- C12H16O5
- Average molar mass
- 240.255 g/mol
- Monoisotopic mass
- 240.09977361
Names & identifiers
- Preferred name
- 1-[5-(2,3-Dihydroxypropoxy)-2-hydroxyphenyl]propan-1-one
- IUPAC
- 1-[5-(2,3-Dihydroxypropoxy)-2-hydroxyphenyl]propan-1-one
- English name
- 5'-(2,3-Dihydroxypropoxy)-2'-hydroxypropiophenone
- Molecular formula
- C12H16O5
- Molecular weight
- 240.25
Names & synonyms
Reaxys ID: 19701055'-(2,3-Dihydroxypropoxy)-2'-hydroxypropiophenone1-Propanone, 1-[5-(2,3-dihydroxypropoxy)-2-hydroxyphenyl]-
Database identifiers
- CAS
956-23-0- PubChem CID
- 120853
- DTXSID
DTXSID50914921- Nikkaji
- J50.841A
Properties
Physicochemical properties
- Melting point
- 79.5 · 79.5–81°C
- Boiling point
- 165 · 165-173 °C(Press: 0.06 Torr)
- Density
- 1.275 · 1.275±0.06 g/cm3(Predicted)
- pka
- 8.54 · 8.54±0.50(Predicted)
Chemistry & industry
Preparation methods
PreparationPreparation by reaction of 3-chloro-1,2- propanediol with 2,5-dihydroxypropiophenone in the presence of sodium ethoxide in ethanol.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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