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886-66-8

886-66-8 Structure

886-66-8 Structure
IdentificationMore
[Name]

1,4-DIPHENYLBUTADIYNE
[CAS]

886-66-8
[Synonyms]

1,4-DIPHENYLBUTADIYNE
1,4-DIPHENYLDIACETYLENE
DIPHENYLDIACETYLENE
TIMTEC-BB SBB008711
(4-Phenyl-1,3-butadiynyl)benzene
1,1’-(1,3-butadiyne-1,4-diyl)bis-benzen
1,1’-(1,3-butadiyne-1,4-diyl)bisbenzene
1,4-Diphenyl-1,3-butadiyne
1,4-Diphenylbut-1,3-diyne
benzene,1,1’-(1,3-butadiyne-1,4-diyl)bis-
Butadiyne, diphenyl-
butadiyne,diphenyl-
Diphenyl-1,3-butadiyne
Diphenylbiacetylene
Diphenylbutadiyne
(4-phenylbuta-1,3-diynyl)benzene
1,1'-(1,3-Butanediyne-1,4-diyl)bisbenzene
1,3-Butadiyne-1,4-diyldibenzene
1,4-Diphenylbutane-1,3-diyne
[EINECS(EC#)]

212-953-1
[Molecular Formula]

C16H10
[MDL Number]

MFCD00004787
[Molecular Weight]

202.25
[MOL File]

886-66-8.mol
Chemical PropertiesBack Directory
[Appearance]

white crystalline needles
[Melting point ]

86-87 °C (lit.)
[Boiling point ]

210 °C / 3mmHg
[density ]

1.2615 (estimate)
[refractive index ]

1.5000 (estimate)
[storage temp. ]

Sealed in dry,Room Temperature
[form ]

powder to crystal
[color ]

White to Light yellow
[Water Solubility ]

Sparingly soluble in water(5.5E-4 g/L) (25°C). Soluble in toluene almost transparency.
[BRN ]

1910105
[CAS DataBase Reference]

886-66-8(CAS DataBase Reference)
[EPA Substance Registry System]

Benzene, 1,1'-(1,3-butadiyne-1,4-diyl)bis- (886-66-8)
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 .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[HS Code ]

29029090
Hazard InformationBack Directory
[Chemical Properties]

white crystalline needles
[Uses]

1,4-Diphenylbutadiyne was used in the preparation of 7,8-dehydropurpurin dimers via two-fold Pd-catalyzed [3+2] annulation of meso-bromoporphyrin.
[Definition]

ChEBI: 1,4-diphenylbutadiyne is an arylacetylene and a member of benzenes. It has a role as a fluorochrome.
[Synthesis Reference(s)]

The Journal of Organic Chemistry, 52, p. 443, 1987 DOI: 10.1021/jo00379a025
Synthetic Communications, 20, p. 2181, 1990 DOI: 10.1080/00397919008053156
Tetrahedron Letters, 26, p. 523, 1985 DOI: 10.1016/S0040-4039(00)61928-7
[General Description]

1,4-Diphenylbutadiyne reacts with [WI2(CO)3(NCMe)2] in CH2Cl2 to give the iodo-bridged dimer [W(μ-I)I(CO)(NCMe)(η2PhC2C2Ph)]2. 1,4-Diphenylbutadiyne on UV irradiation with olefins such as 2,3-dimethyl-2-butene, 1,4-cyclohexadiene and dimethyl fumarate yields cross-cycloaddition products.
Spectrum DetailBack Directory
[Spectrum Detail]

1,4-DIPHENYLBUTADIYNE(886-66-8)MS
1,4-DIPHENYLBUTADIYNE(886-66-8)1HNMR
1,4-DIPHENYLBUTADIYNE(886-66-8)13CNMR
1,4-DIPHENYLBUTADIYNE(886-66-8)IR1
1,4-DIPHENYLBUTADIYNE(886-66-8)IR2
1,4-DIPHENYLBUTADIYNE(886-66-8)Raman
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

1,4-Diphenylbutadiyne, 99%(886-66-8)
[Sigma Aldrich]

886-66-8(sigmaaldrich)
[TCI AMERICA]

1,4-Diphenylbutadiyne,>98.0%(GC)(886-66-8)
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