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158816-55-8

158816-55-8 Structure

158816-55-8 Structure
IdentificationBack Directory
[Name]

3,4,5-TRIFLUOROPHENYLACETYLENE
[CAS]

158816-55-8
[Synonyms]

3,4,5-Trifluorophenylacetylen
3,4,5-TRIFLUOROPHENYLACETYLENE
5-ETHYNYL-1,2,3-TRIFLUORO-BENZENE
Benzene, 5-ethynyl-1,2,3-trifluoro-
5-Ethynyl-1,2,3-trifluorobenzene >
Benzene, 5-ethynyl-1,2,3-trifluoro- (9CI)
[Molecular Formula]

C8H3F3
[MDL Number]

MFCD08458177
[MOL File]

158816-55-8.mol
[Molecular Weight]

156.1
Chemical PropertiesBack Directory
[Boiling point ]

53-54/1mm
[density ]

1.27±0.1 g/cm3(Predicted)
[refractive index ]

1.4720 to 1.4760
[storage temp. ]

Store at room temperature
[form ]

clear liquid
[color ]

Colorless to Light orange to Yellow
[InChI]

InChI=1S/C8H3F3/c1-2-5-3-6(9)8(11)7(10)4-5/h1,3-4H
[InChIKey]

BZXWRVPVZZZAKB-UHFFFAOYSA-N
[SMILES]

C1(F)=CC(C#C)=CC(F)=C1F
Safety DataBack Directory
[Hazard Codes ]

Xi,T
[Risk Statements ]

25
[Safety Statements ]

45
[RIDADR ]

UN 1993 3/PG III
[WGK Germany ]

WGK 3
[Hazard Note ]

Irritant
[HazardClass ]

3
[PackingGroup ]

III
[HS Code ]

2903998090
[Storage Class]

6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
[Hazard Classifications]

Acute Tox. 3 Oral
Spectrum DetailBack Directory
[Spectrum Detail]

3,4,5-TRIFLUOROPHENYLACETYLENE(158816-55-8)1HNMR
3,4,5-TRIFLUOROPHENYLACETYLENE(158816-55-8)FT-IR
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