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ChemicalBook--->CAS DataBase List--->611-70-1

611-70-1

611-70-1 Structure

611-70-1 Structure
IdentificationMore
[Name]

Isobutyrophenone
[CAS]

611-70-1
[Synonyms]

2-METHYL-1-PHENYL-1-PROPANONE
ALPHA-METHYLPROPIOPHENONE
ISOBUTYROPHENONE
ISOBUTYRYLBENZENE
ISOPROPYL PHENYL KETONE
PHENYL ISOPROPYL KETONE
1-Propanone, 2-methyl-1-phenyl-
1-Propanone,2-methyl-1-phenyl-
2-methyl-1-phenyl-1-propanon
2-methyl-1-phenyl-propan-1-one
2-Methylpropiophenone
Isobutyrophenone,97%
ISOBUTROPHENONE
2-methyl-1-propan-1-one
2-Methyl-1-phenyl-1-propanone, Isobutyrylbenzene
1-Phenyl-2-methyl-1-propanone
2-Methyl-1-phenylpropanone
(2-Methyl-1-oxopropyl)benzene
α-Methylpropiophenone
[EINECS(EC#)]

210-275-0
[Molecular Formula]

C10H12O
[MDL Number]

MFCD00008917
[Molecular Weight]

148.2
[MOL File]

611-70-1.mol
Chemical PropertiesBack Directory
[Appearance]

clear colorless to very slightly yellow liquid
[Melting point ]

1 °C
[Boiling point ]

217 °C (lit.)
[density ]

0.988 g/mL at 25 °C(lit.)
[vapor pressure ]

1 mm Hg ( 50 °C)
[refractive index ]

n20/D 1.517(lit.)
[Fp ]

184 °F
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

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

Oil
[color ]

Colourless
[Water Solubility ]

immiscible
[BRN ]

774499
[CAS DataBase Reference]

611-70-1(CAS DataBase Reference)
[NIST Chemistry Reference]

Isopropyl phenyl ketone(611-70-1)
[EPA Substance Registry System]

611-70-1(EPA Substance)
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
[TSCA ]

Yes
[HS Code ]

29143900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Benzene-->Isobutyryl chloride
[Preparation Products]

2-BROMO-2-METHYLPROPIOPHENONE-->2-METHYL-3-HEPTANONE-->2-METHYL-1-PHENYLPROPENE-->2-Methylmercaptobenzothiazole-->2-METHYL-1-PHENYLPROPAN-1-AMINE-HCl-->4-ISO-BUTYLBUTYROPHENONE-->2-Hydroxy-2-methylpropiophenone
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2-Methyl-1-phenyl-1-propanone(611-70-1).msds
Hazard InformationBack Directory
[Chemical Properties]

clear colorless to very slightly yellow liquid
[Uses]

Isobutyrophenone was used as an internal standard in the determination of hydroxyzine hydrochloride and benzyl alcohol in injection solutions. It was also used in the preparation of alpha-hydroxyisobutyrophenone.
[Uses]

Isobutyrophenone is used as an internal standard in the determination of hydroxyzine hydrochloride and benzyl alcohol in injection solutions. It is also used in the preparation of alpha-hydroxyisobutyrophenone. Isobutyrophenone is employed as photosensitizer intermediate. It can react with bromoacetic acid ethyl ester to get 3-hydroxy-4-methyl-3-phenyl-valeric acid ethyl ester.
[Preparation]

Isobutyrophenone synthesis: Benzene underwent a Friedel–Crafts acylation with isobutyryl chloride to synthesize isobutyrophenone. The reaction was performed using excess benzene as a replacement for a typical solvent and heat to reflux (88 °C) for a period of 3 hours. Any unreacted benzene was recovered after the reaction during the distillation process. A 66 % yield of isobutyrophenone was obtained from the solar synthesis, compared to a 44 % yield from an in-lab, electrical heating analysis.
Isobutyrophenone synthesis
[Synthesis Reference(s)]

Journal of the American Chemical Society, 71, p. 1061, 1949 DOI: 10.1021/ja01171a084
The Journal of Organic Chemistry, 32, p. 404, 1967 DOI: 10.1021/jo01288a032
Tetrahedron Letters, 14, p. 2491, 1973
[Flammability and Explosibility]

Nonflammable
Spectrum DetailBack Directory
[Spectrum Detail]

Isobutyrophenone(611-70-1)MS
Isobutyrophenone(611-70-1)1HNMR
Isobutyrophenone(611-70-1)13CNMR
Isobutyrophenone(611-70-1)IR1
Isobutyrophenone(611-70-1)IR2
Isobutyrophenone(611-70-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

Isobutyrophenone, 97%(611-70-1)
[Alfa Aesar]

Isobutyrophenone, 97%(611-70-1)
[Sigma Aldrich]

611-70-1(sigmaaldrich)
[TCI AMERICA]

Isobutyrophenone,>98.0%(GC)(611-70-1)
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