ChemicalBook--->CAS DataBase List--->40786-69-4

40786-69-4

40786-69-4 Structure

40786-69-4 Structure
IdentificationMore
[Name]

2',4'-DIHYDROXY-3'-PROPYLACETOPHENONE
[CAS]

40786-69-4
[Synonyms]

1-(2,4-DIHYDROXY-3-PROPYLPHENYL)ETHAN-1-ONE
2',4'-DIHYDROXY-3'-PROPYLACETOPHENONE
2',4'-DIHYDROXY-3'-PROPYLACETOPHENONE, 9 9%
(2,4-Dihydroxy-3-n-propylphenyl)ethanone
[Molecular Formula]

C11H14O3
[MDL Number]

MFCD00068616
[Molecular Weight]

194.23
[MOL File]

40786-69-4.mol
Chemical PropertiesBack Directory
[Melting point ]

124-127 °C (lit.)
[Boiling point ]

361.0±12.0 °C(Predicted)
[density ]

1.162±0.06 g/cm3(Predicted)
[storage temp. ]

2-8°C
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

8.49±0.23(Predicted)
[color ]

Light Brown
[InChI]

1S/C11H14O3/c1-3-4-9-10(13)6-5-8(7(2)12)11(9)14/h5-6,13-14H,3-4H2,1-2H3
[InChIKey]

QGGRBWUQXAFYEC-UHFFFAOYSA-N
[SMILES]

CCCc1c(O)ccc(C(C)=O)c1O
[CAS DataBase Reference]

40786-69-4(CAS DataBase Reference)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
[WGK Germany ]

3
[Hazard Note ]

Irritant
[HS Code ]

2914500090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
Hazard InformationBack Directory
[Uses]

1-(2,4-Dihydroxy-3-propylphenyl)ethanone is a reactant used in the synthesis of 2’-hydroxychalcones which affect cell growth inihibition , initiates apoptosis in human tumor cell lines.
[Preparation]

Preparation by reaction of acetonitrile on 2-propylresorcinol (Hoesch reaction) (86%).
Spectrum DetailBack Directory
[Spectrum Detail]

2',4'-DIHYDROXY-3'-PROPYLACETOPHENONE(40786-69-4)1HNMR
2',4'-DIHYDROXY-3'-PROPYLACETOPHENONE(40786-69-4)FT-IR
2',4'-DIHYDROXY-3'-PROPYLACETOPHENONE(40786-69-4)IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

40786-69-4(sigmaaldrich)
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