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160075

Sigma-Aldrich

1-Phenyl-1-cyclopropanecarboxylic acid

97%

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About This Item

Linear Formula:
C6H5C3H4CO2H
CAS Number:
6120-95-2
Molecular Weight:
162.19
EC Number:
228-090-9
MDL number:
MFCD00001288
UNSPSC Code:
12352100
PubChem Substance ID:
24849852
NACRES:
NA.22

Assay

97%

form

solid

mp

85-87 °C (lit.)

SMILES string

OC(=O)C1(CC1)c2ccccc2

InChI

1S/C10H10O2/c11-9(12)10(6-7-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H,11,12)

InChI key

IWWCCNVRNHTGLV-UHFFFAOYSA-N

Application

1-Phenyl-1-cyclopropanecarboxylic acid was used in the preparation of bis[(1-phenyl-1-cyclopropyl)carbonyl] peroxide via reaction with hydrogen peroxide in the presence of N,N′-dicyclohexylcarbodiimide.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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Bis [(1-phenyl-1-cyclopropyl) carbonyl] peroxide.
Bethell D, et al.
Acta Crystallographica Section B, Structural Science, Crystal Engineering and Materials, 38(5), 1677-1679 (1982)
Radoslaw Laufer et al.
Bioorganic & medicinal chemistry, 22(17), 4968-4997 (2014-07-22)
TTK kinase was identified by in-house siRNA screen and pursued as a tractable, novel target for cancer treatment. A screening campaign and systematic optimization, supported by computer modeling led to an indazole core with key sulfamoylphenyl and acetamido moieties at

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