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539872

Sigma-Aldrich

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

97%

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About This Item

Empirical Formula (Hill Notation):
C12H11FO2
CAS Number:
55579-72-1
Molecular Weight:
206.21
MDL number:
MFCD00174037
UNSPSC Code:
12352100
PubChem Substance ID:
24878271
NACRES:
NA.22

Quality Level

100

Assay

97%

mp

186-189 °C (lit.)

functional group

fluoro
ketone

SMILES string

Fc1ccc(cc1)C2CC(=O)CC(=O)C2

InChI

1S/C12H11FO2/c13-10-3-1-8(2-4-10)9-5-11(14)7-12(15)6-9/h1-4,9H,5-7H2

InChI key

LBTLJACXBCUFEF-UHFFFAOYSA-N

Related Categories

General description

5-(4-Fluorophenyl)-1,3-cyclohexanedione is a cyclohexane-1,3-dione derivative.

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

Regulatory Listings

Regulatory Listings are mainly provided for chemical products. Only limited information can be provided here for non-chemical products. No entry means none of the components are listed. It is the user’s obligation to ensure the safe and legal use of the product.

JAN Code

539872-5G:
539872-BULK:
539872-1G:
539872-VAR:

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Certificates of Analysis (COA)

Lot/Batch Number
MKCQ1685
MKCJ3117
00711TI

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Cyclocondensation of 3 (5)-Aminopyrazoles with Arylglyoxals and Cyclohexane-1, 3-diones.
Petrova ON, et al.
Chemistry of Heterocyclic Compounds, 49(7), 955-967 (2013)

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