Basic information
- CAS
66922-70-1- Standard SMILES
COc1cc(C(=O)C(O)O)ccc1O- InChIKey
SGFVYAYEGJHREZ-UHFFFAOYSA-N- Molecular formula
- C9H10O5
- Average molar mass
- 198.17 g/mol
- Monoisotopic mass
- 198.05282342
Names & identifiers
- Preferred name
- Acetophenone, 3'-methoxy-2,2,4'-trihydroxy-
- IUPAC
- 2,2-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)ethanone
- English name
- 3'-Methoxy-α,α,4'-trihydroxyacetophenone
- Molecular formula
- C9H10O5
- Molecular weight
- 198.17
Names & synonyms
66922-70-13'-Methoxy-2,2,4'-trihydroxyacetophenoneACETOPHENONE, 3'-METHOXY-2,2,4'-TRIHYDROXY-DTXSID20217072RefChem:316938DTXCID201395632,2,4'-Trihydroxy-3'-methoxy-acetophenone2,2-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)ethanone2,2-Dihydroxy-1-(4-hydroxy-3-methoxyphenyl)ethan-1-one3'-Methoxy-alpha,alpha,4'-trihydroxyacetophenonestarbld00077582,2-Dihydroxy-1-(4-hydroxy-3-methoxyphenyl)-ethanone
Show more names
3'-Methoxy-α,α,4'-trihydroxyacetophenoneEthanone, 2,2-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)-2,2,4′-Trihydroxy-3′-methoxy-acetophenone, CAS 66922-70-1
AKOS0302426372,2,4-Trihydroxy-3-methoxy-acetophenoneDB-260218
Database identifiers
- CAS
66922-70-1- PubChem CID
- 48374
- DTXSID
DTXSID20217072
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 87 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 203
Physicochemical properties
- storage temp.
- Refrigerator, under inert atmosphere
- solubility
- Dichloromethane, Dimethyl Sulfoxide, Methanol
- form
- Solid
- color
- Orange
Chemistry & industry
Applications
UsesShows central nervous system depressant activity.
Suppliers8 total
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
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凯试（上海）科技有限公司021-50135380 · [email protected]
career henan chemical co+86-0371-86658258 · [email protected]
深圳聚合生化科技有限公司+86-400-002-6226 13028896684 · [email protected]
爆牛贸易重庆有限公司+86-023-6139-8061 +86-86-13650506873 · [email protected]
北京百灵威科技有限公司18210857532 18210857532 · [email protected]
Related reactions
0 records
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Compound notes
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