ChemicalBook--->CAS DataBase List--->26465-81-6

26465-81-6

26465-81-6 Structure

26465-81-6 Structure
IdentificationBack Directory
[Name]

3,3-DIMETHYL-1-INDANONE
[CAS]

26465-81-6
[Synonyms]

AKOS BC-0396
3,3-DIMETHYL-1-INDANONE
3,3-dimethylindan-1-one
3,3-Dimethyl-1-indanone>
3,3-dimethyl-2H-inden-1-one
1,1-Dimethyl-1H-indene-3(2H)-one
1H-Inden-1-one,2,3-dihydro-3,3-di-
3,3-Dimethyl-2,3-dihydro-1H-inden-1-one
3,3-Dimethyl-2,3-dihydro-1H-indene-1-one
1H-Inden-1-one, 2,3-dihydro-3,3-diMethyl-
[EINECS(EC#)]

251-203-8
[Molecular Formula]

C11H12O
[MDL Number]

MFCD01846169
[MOL File]

26465-81-6.mol
[Molecular Weight]

160.21
Chemical PropertiesBack Directory
[Boiling point ]

122 °C / 16mmHg
[density ]

1.03
[refractive index ]

1.5410-1.5450
[storage temp. ]

Refrigerator
[form ]

clear liquid
[color ]

Light yellow to Brown
[InChI]

InChI=1S/C11H12O/c1-11(2)7-10(12)8-5-3-4-6-9(8)11/h3-6H,7H2,1-2H3
[InChIKey]

QWZAOSKLFKAEOK-UHFFFAOYSA-N
[SMILES]

C1(=O)C2=C(C=CC=C2)C(C)(C)C1
[LogP]

3.130 (est)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[Risk Statements ]

52
[HS Code ]

2914390090
Hazard InformationBack Directory
[Chemical Properties]

Colorless Liquid
[Uses]

3,3-Dimethyl 1-indanone is used as a reagent to synthesize Indole (I577320) and Indoline (I627200) chromophores, compounds that have potential antioxidant properties. 3,3-Dimethyl 1-indanone is also a component of cigarette tobacco.
[Synthesis Reference(s)]

Journal of the American Chemical Society, 108, p. 6424, 1986 DOI: 10.1021/ja00280a070
Spectrum DetailBack Directory
[Spectrum Detail]

3,3-DIMETHYL-1-INDANONE(26465-81-6)1HNMR
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