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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)

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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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