ChemicalBook--->CAS DataBase List--->104-20-1

104-20-1

104-20-1 Structure

104-20-1 Structure
IdentificationMore
[Name]

4-(4-Methoxyphenyl)-2-butanone
[CAS]

104-20-1
[Synonyms]

1-(4-METHOXYPHENYL)-3-BUTANONE
1-(P-METHOXYPHENYL)-3-BUTANONE
4-(4'-METHOXYPHENYL)-2-BUTANONE
4-(4-METHOXYPHENYL)-2-BUTANONE
4-(4-METHOXYPHENYL)BUTAN-2-ONE
4-ANISYLACETONE
4-METHOXYBENZYLACETONE
4-(PARA METHOXYPHENYL)-2-BUTANONE
4-(P-METHOXYPHENYL)-2-BUTANONE
4-(P-METHOXYPHENYL)-3-BUTAN-2-ONE
4-(P-METHOXYPHENYL) BUTANONE
ANISALACETONE
ANISYLACETONE
BUTANONE, 4-(P-METHOXYPHENYL)-2-
FEMA 2672
METHOXY PHENYL BUTANONE
PARA ANISYL ACETONE
P-METHOXY PHENYL BUTANONE
2-Butanone, 4-(p-methoxyphenyl)-
4-(4-
[EINECS(EC#)]

203-184-2
[Molecular Formula]

C11H14O2
[MDL Number]

MFCD00008791
[Molecular Weight]

178.23
[MOL File]

104-20-1.mol
Chemical PropertiesBack Directory
[Appearance]

clear colourless to pale yellow liquid
[Melting point ]

8 °C (lit.)
[Boiling point ]

152-153 °C/15 mmHg (lit.)
[density ]

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

9-2000Pa at 20-115℃
[FEMA ]

2672
[refractive index ]

n20/D 1.519(lit.)
[Fp ]

>230 °F
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

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

Oil
[color ]

A colourless oily liquid with a sweet floral odour
[Odor]

at 100.00 %. sweet dried raspberry rose cherry fruity cassie absolute
[Odor Type]

berry
[Water Solubility ]

Not miscible in water.
[JECFA Number]

818
[BRN ]

1869592
[LogP]

2 at 23.1℃
[CAS DataBase Reference]

104-20-1(CAS DataBase Reference)
[NIST Chemistry Reference]

2-Butanone, 4-(4-methoxyphenyl)-(104-20-1)
[EPA Substance Registry System]

104-20-1(EPA Substance)
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

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

S23:Do not breathe gas/fumes/vapor/spray (appropriate wording to be specified by the manufacturer) .
S24/25:Avoid contact with skin and eyes .
[WGK Germany ]

2
[RTECS ]

EL9085500
[TSCA ]

Yes
[HS Code ]

29145090
[Safety Profile]

Low oral and skin toxicity. A flammable liquid. When heated to decomposition it emits acrid smoke and irritating fumes.
[Toxicity]

Both the acute oral LD50 value in rats and the acute dermal LD50 value in rabbits exceeded 5 g/kg (Russell, 1973)
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

Anisylacetone(104-20-1).msds
Hazard InformationBack Directory
[Description]

4-(p-Methoxyphenyl)-2-butanone has an intensely sweet, floral, fruity odor and a cherry-raspberry flavor at low concentrations. May be prepared by condensing acetone with anisaldehyde to yield anisylidene acetone and subsequent hydrogenation in the presence of Pd catalyst.
[Chemical Properties]

4-(p-Methoxyphenyl)-2-butanone has an intensely sweet, floral,fruity odor and cherry–raspberry flavor at low concentrations.
[Chemical Properties]

clear colourless to pale yellow liquid
[Occurrence]

Contained (approximately 53% level) in the odorous principle obtained by extraction and hydrolysis from aloe wood (Aquilaria algallocha Roxb.) and in anise.
[Uses]

4-(4-Methoxyphenyl)-2-butanone is used as pharmaceutical intermediate.
[Uses]

In insect attractants, organic synthesis, flavoring.
[Definition]

ChEBI: 4-(4-Methoxyphenyl)-2-butanone is a member of methoxybenzenes.
[Preparation]

By condensing acetone with anisaldehyde to yield anisylidene acetone and subsequent hydrogenation in the presence of Pd catalyst.
[Aroma threshold values]

Aroma characteristics at 5.0%: sweet, fruity, woody, powdery, honey, vanilla, raspberry and ionone-like.
[Taste threshold values]

Taste characteristics at 40 ppm: floral, woody, ionone, raspberry, fruity, spice and berry.
[Synthesis Reference(s)]

Tetrahedron Letters, 33, p. 951, 1992 DOI: 10.1016/S0040-4039(00)91585-5
Spectrum DetailBack Directory
[Spectrum Detail]

4-(4-Methoxyphenyl)-2-butanone(104-20-1)MS
4-(4-Methoxyphenyl)-2-butanone(104-20-1)1HNMR
4-(4-Methoxyphenyl)-2-butanone(104-20-1)13CNMR
4-(4-Methoxyphenyl)-2-butanone(104-20-1)IR1
4-(4-Methoxyphenyl)-2-butanone(104-20-1)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

4-(4-Methoxyphenyl)-2-butanone, 98%(104-20-1)
[Alfa Aesar]

4-(4-Methoxyphenyl)-2-butanone, 99%(104-20-1)
[Sigma Aldrich]

104-20-1(sigmaaldrich)
[TCI AMERICA]

4-(4-Methoxyphenyl)-2-butanone,>96.0%(GC)(104-20-1)
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