ChemicalBook--->CAS DataBase List--->1896-62-4

1896-62-4

1896-62-4 Structure

1896-62-4 Structure
IdentificationMore
[Name]

(E)-4-Phenyl-3-buten-2-one
[CAS]

1896-62-4
[Synonyms]

1-PHENYL-1-BUTEN-3-ONE
4-PHENYL-3-BUTEN-2-ONE
ACETOCINNAMONE
BENZALACETONE
BENZALAOETONE
BENZYLIDENEACETONE
CINNAMYL METHYL KETONE
(e)-4-phenyl-3-buten-2-one
FEMA 2881
METHYL STYRYL KETONE
TRANS-4-PHENYL-3-BUTEN-2-ONE
TRANS-4-PHENYL-3-BUTENE-2-ONE
TRANS-BENZALACETONE
TRANS-BENZYLIDENEACETONE
(E)-1-Buten-3-one, 1-phenyl
(e)-3-buten-2-on
Methyl trans-styryl ketone
methyltrans-styrylketone
Tpbo
trans-4-phenyl-but-3-en-2-one
[EINECS(EC#)]

204-555-1
[Molecular Formula]

C10H10O
[MDL Number]

MFCD00008779
[Molecular Weight]

146.19
[MOL File]

1896-62-4.mol
Chemical PropertiesBack Directory
[Appearance]

yellowish crystalline substance
[Melting point ]

39-42 °C(lit.)
[Boiling point ]

260-262 °C(lit.)
[density ]

1,038 g/cm3
[vapor pressure ]

0.01 mm Hg ( 25 °C)
[FEMA ]

2881
[refractive index ]

1.5836 (estimate)
[Fp ]

150 °F
[storage temp. ]

Keep in dark place,Sealed in dry,Room Temperature
[solubility ]

alcohol: freely soluble(lit.)
[form ]

Crystalline Substance
[color ]

Yellow
[Water Solubility ]

practically insoluble
[Merck ]

14,1137
[InChI]

1S/C10H10O/c1-9(11)7-8-10-5-3-2-4-6-10/h2-8H,1H3/b8-7+
[InChIKey]

BWHOZHOGCMHOBV-BQYQJAHWSA-N
[SMILES]

CC(=O)\C=C\c1ccccc1
[CAS DataBase Reference]

1896-62-4(CAS DataBase Reference)
[NIST Chemistry Reference]

3-Buten-2-one, 4-phenyl-, (E)-(1896-62-4)
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
R43:May cause sensitization by skin contact.
R42/43:May cause sensitization by inhalation and skin contact .
[Safety Statements ]

S7:Keep container tightly closed .
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S37/39:Wear suitable gloves and eye/face protection .
[RIDADR ]

UN 3077 9/PG III
[WGK Germany ]

3
[RTECS ]

EN0330050
[F ]

8
[HazardClass ]

9
[PackingGroup ]

III
[HS Code ]

29143990
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
Skin Sens. 1
STOT SE 3
[Toxicity]

mma-sat 300 mg/plate FCTOD7 20,427,82
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

trans-4-Phenyl-3-buten-2-one(1896-62-4).msds
Hazard InformationBack Directory
[Chemical Properties]

light yellow low melting crystalline mass or
[Uses]

trans-4-Phenyl-3-buten-2-one is used in various synthetic preparations.
[Definition]

ChEBI: The trans-isomer of benzylideneacetone. It acts as an inhibitor of the enzyme phospholipase A2 (EC 3.1.1.4) of insects like diamond back moth.
[General Description]

trans-4-Phenyl-3-buten-2-one forms trans-4-(4-hydroxyphenyl)-3-buten-2-one (4-OH-PBO) as a metabolite when incubated with liver microsomes of untreated rats in the presence of NADPH.
[Safety Profile]

Mutation data reported. Aflammable liquid. When heated to decomposition it emitsacrid smoke and irritating vapors.
Spectrum DetailBack Directory
[Spectrum Detail]

trans-4-Phenyl-3-buten-2-one(1896-62-4)MS
trans-4-Phenyl-3-buten-2-one(1896-62-4)1HNMR
trans-4-Phenyl-3-buten-2-one(1896-62-4)13CNMR
trans-4-Phenyl-3-buten-2-one(1896-62-4)IR1
trans-4-Phenyl-3-buten-2-one(1896-62-4)IR2
trans-4-Phenyl-3-buten-2-one(1896-62-4)IR3
trans-4-Phenyl-3-buten-2-one(1896-62-4)Raman
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

trans-4-Phenyl-3-buten-2-one, 99%(1896-62-4)
[Sigma Aldrich]

1896-62-4(sigmaaldrich)
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