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13621-25-5

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13621-25-5 Structure

13621-25-5 Structure
IdentificationMore
[Name]

5,7-Dimethyl-1-tetralone
[CAS]

13621-25-5
[Synonyms]

5,7-DIMETHYL-1-TETRALONE
AKOS BC-0291
5,7-Dimethyl-3,4-dihydro-1(2H)-naphthalenone
3,4-dihydro-5,7-dimethylnaphthalen-1(2H)-one
5,7-Dimethyl-3,4-dihydronaphthalen-1(2H)-one
3,4-Dihydro-5,7-dimethyl-1(2H)-naphthalenone
5,7-Dimethyl-1,2,3,4-tetrahydronaphthalene-1-one
5,7-Dimethyltetralin-1-one
[EINECS(EC#)]

237-104-2
[Molecular Formula]

C12H14O
[MDL Number]

MFCD00001694
[Molecular Weight]

174.24
[MOL File]

13621-25-5.mol
Chemical PropertiesBack Directory
[Melting point ]

48-50 °C(lit.)
[Boiling point ]

98-100 °C0.2 mm Hg(lit.)
[density ]

0.9540 (rough estimate)
[refractive index ]

1.5370 (estimate)
[Fp ]

>230 °F
[form ]

solid
[InChI]

1S/C12H14O/c1-8-6-9(2)10-4-3-5-12(13)11(10)7-8/h6-7H,3-5H2,1-2H3
[InChIKey]

UYJCNOMEGPDXMV-UHFFFAOYSA-N
[SMILES]

Cc1cc(C)c2CCCC(=O)c2c1
[CAS DataBase Reference]

13621-25-5(CAS DataBase Reference)
[NIST Chemistry Reference]

1(2H)-Naphthalenone, 3,4-dihydro-5,7-dimethyl-(13621-25-5)
Safety DataBack Directory
[WGK Germany ]

3
[HS Code ]

2914390090
[Storage Class]

13 - Non Combustible Solids
Hazard InformationBack Directory
[Uses]

5,7-Dimethyl-1-tetralone was used in the synthesis of new coumarin derivatives. It was used in the synthesis of 5,7-dimethyl-1,2-naphthoquinones by microwave-assisted selenium dioxide oxidation reaction.
Spectrum DetailBack Directory
[Spectrum Detail]

5,7-Dimethyl-1-tetralone(13621-25-5)1HNMR
5,7-Dimethyl-1-tetralone(13621-25-5)FT-IR
5,7-Dimethyl-1-tetralone(13621-25-5)Raman
5,7-Dimethyl-1-tetralone(13621-25-5)IR
Well-known Reagent Company Product InformationBack Directory
[Sigma Aldrich]

13621-25-5(sigmaaldrich)
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