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539783

Sigma-Aldrich

5-(4-Chlorophenyl)-1,3-cyclohexanedione

95%

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About This Item

Linear Formula:
ClC6H4C6H7O2
CAS Number:
Molecular Weight:
222.67
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:

Assay

95%

mp

185-189 °C (lit.)

functional group

chloro
ketone

SMILES string

Clc1ccc(cc1)C2CC(=O)CC(=O)C2

InChI

1S/C12H11ClO2/c13-10-3-1-8(2-4-10)9-5-11(14)7-12(15)6-9/h1-4,9H,5-7H2

InChI key

MAFYKXZPGMHTIA-UHFFFAOYSA-N

Application

5-(4-Chlorophenyl)-1,3-cyclohexanedione may be used in the synthesis of 3-(5-(4-chlorophenyl)-3-oxocyclohex-1-enylamino)thiophene-2-carbonitrile.

Storage Class Code

13 - Non 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

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Synthesis of 9-amino-5, 6, 7, 8-tetrahydrothieno [3, 2-b] quinoline and 9-amino-5, 6, 7, 8-tetrahydrothieno [3, 2-b] quinolin-8-ol derivatives.
Song YH and Jo BS.
Journal of Heterocyclic Chemistry, 46(6), 1132-1136 (2009)

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