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10147-11-2

10147-11-2 Structure

10147-11-2 Structure
IdentificationBack Directory
[Name]

3-PHENYL-1-PROPYNE
[CAS]

10147-11-2
[Synonyms]

Propargylbenzene
prop-2-ynylbenzene
3-PHENYL-1-PROPYNE
(2-Propynyl)benzene
3-PHENYL-1-PROPYNE 97%
3-Phenyl-1-propyne, 97%, stab.
Propargylbenzene Benzylacetylene
3-Phenyl-1-propyne,97%,stabilized
3-Phenyl-1-propyne, stabilized, 97%
3-Phenyl-1-propyne ,96% [stabilized]
3-Phenyl-1-propyne, stabilized, 97% 1GR
3-Phenyl-1-propyne, stabilized, 97% 5GR
3-Phenyl-1-propyne (stabilized with BHT)
3-Phenyl-1-propyne contains 250 ppM BHT as inhibitor, 97%
3-Phenyl-1-propyne contains ca.250 ppm BHT as inhibitor, 97%
[Molecular Formula]

C9H8
[MDL Number]

MFCD00134431
[MOL File]

10147-11-2.mol
[Molecular Weight]

116.16
Chemical PropertiesBack Directory
[Appearance]

Clear colorless to yellow liquid
[Boiling point ]

75 °C20 mm Hg(lit.)
[density ]

0.934 g/mL at 25 °C(lit.)
[refractive index ]

n20/D 1.526(lit.)
[Fp ]

126 °F
[storage temp. ]

Flammables area
[solubility ]

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

Liquid
[color ]

Clear colorless to yellow
[Specific Gravity]

0.934
[Stability:]

Volatile
[CAS DataBase Reference]

10147-11-2
Hazard InformationBack Directory
[Chemical Properties]

Clear colorless to yellow liquid
[Uses]

3-Phenyl-1-propyne is used as a starting material in the synthesis of 4-phenyl-2-butyn-1-ol. It is also used in the preparation of beta-hydroxytriazoles and indoles.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 47, p. 1837, 1982 DOI: 10.1021/jo00349a007
[General Description]

3-Phenyl-1-propyne is a 3-aryl-1-propyne. The electronic transition of the resonance-stabilized 1-phenylpropargyl radical, produced in a jet-cooled discharge of 3-phenyl-1-propyne, has been studied by laser-induced fluorescence excitation and dispersed single vibronic level fluorescence (SVLF) spectroscopy. The microwave rotational spectrum of 3-phenyl-1-propyne (propargyl benzene) has been studied and its stable conformation is reported to have coplanar carbon atoms. Reaction of N-methyl-N-phenylhydrazine or N-phenylhydrazine with 3-phenyl-1-propyne is reported to yield indoles. 3-Phenyl-1-propyne is reported to react with styrene oxide and sodium azide, to afford β-hydroxytriazoles.
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

10-36/37/38
[Safety Statements ]

16-26-36/37/39-37/39
[RIDADR ]

UN 3295 3/PG 3
[WGK Germany ]

3
[HazardClass ]

3.2
[PackingGroup ]

III
[HS Code ]

29029090
Spectrum DetailBack Directory
[Spectrum Detail]

3-PHENYL-1-PROPYNE(10147-11-2)1HNMR
3-PHENYL-1-PROPYNE(10147-11-2)Raman
3-PHENYL-1-PROPYNE(10147-11-2)IR
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