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29329-03-1

29329-03-1 Structure

29329-03-1 Structure
IdentificationBack Directory
[Name]

5-Hexynal
[CAS]

29329-03-1
[Synonyms]

5-Hexynal
hex-5-ynal
[Molecular Formula]

C6H8O
[MDL Number]

MFCD12025044
[MOL File]

29329-03-1.mol
[Molecular Weight]

96.13
Chemical PropertiesBack Directory
[Melting point ]

-61°C (estimate)
[Boiling point ]

169.66°C (estimate)
[density ]

0.8948 (estimate)
[refractive index ]

1.4132 (estimate)
[form ]

Liquid (Density: 0.885±0.06 g/cm3)
Hazard InformationBack Directory
[Uses]

5-Hexynal (compound 3) is a PROTAC linker that can be used to prepare the PROTAC product iRucaparib-TP3 (HY-130645)[1].
[Synthesis Reference(s)]

Organic Syntheses, Coll. Vol. 6, p. 679, 1988
The Journal of Organic Chemistry, 40, p. 579, 1975 DOI: 10.1021/jo00893a008
[References]

[1] Oblinger E, et al. A new stereoselective method for the preparation of allylic alcohols[J]. Journal of the American Chemical Society, 1997, 119(38): 9065-9066.
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