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10297-09-3

10297-09-3 Structure

10297-09-3 Structure
IdentificationBack Directory
[Name]

7-Octynoic acid
[CAS]

10297-09-3
[Synonyms]

7-Octynoic acid
oct-7-ynoic acid
WJBHDZBQZOMDFF-UHFFFAOYSA-N
[Molecular Formula]

C8H12O2
[MDL Number]

MFCD19228078
[MOL File]

10297-09-3.mol
[Molecular Weight]

140.18
Chemical PropertiesBack Directory
[Melting point ]

19°C
[Boiling point ]

290.64°C (rough estimate)
[density ]

1.0450 (rough estimate)
[refractive index ]

1.4502
[solubility ]

DMSO: 150 mg/mL (1070.05 mM)
[form ]

Liquid
[pka]

4.74±0.10(Predicted)
[color ]

Colorless to light pink
[Water Solubility ]

Water: 5 mg/mL (35.67 mM)
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)Corrosion (GHS05)
GHS07,GHS05
[Signal word ]

Danger
[Hazard statements ]

H314-H335
[Precautionary statements ]

P260-P264-P280-P301+P330+P331-P303+P361+P353-P363-P304+P340-P310-P321-P305+P351+P338-P405-P501
Hazard InformationBack Directory
[Uses]

7-Octynoic acid (compound 42) is a PROTAC linker and can be used in the synthesis of a series of PROTACs. PROTACs contain two different ligands connected by a linker; one is a ligand for an E3 ubiquitin ligase and the other is for the target protein. PROTACs exploit the intracellular ubiquitin-proteasome system to selectively degrade target proteins[1]. 7-Octynoic acid is a click chemistry reagent, it contains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
[Definition]

ChEBI: 7-octynoic acid is a medium-chain fatty acid.
[IC 50]

Alkyl-Chain
[References]

[1] Bai L, et al. A Potent and Selective Small-Molecule Degrader of STAT3 Achieves Complete Tumor Regression In Vivo. Cancer Cell. 2019 Nov 11;36(5):498-511.e17. DOI:10.1016/j.ccell.2019.10.002
Spectrum DetailBack Directory
[Spectrum Detail]

7-Octynoic acid(10297-09-3)1HNMR
7-Octynoic acid(10297-09-3)1HNMR
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