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196878

Sigma-Aldrich

3-(Trifluoromethyl)benzaldehyde

97%

Synonym(s):

α,α,α-Trifluoro-m-tolualdehyde

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About This Item

Linear Formula:
CF3C6H4CHO
CAS Number:
Molecular Weight:
174.12
Beilstein:
2327537
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

form

liquid

refractive index

n20/D 1.465 (lit.)

bp

83-86 °C/30 mmHg (lit.)

density

1.301 g/mL at 25 °C (lit.)

SMILES string

[H]C(=O)c1cccc(c1)C(F)(F)F

InChI

1S/C8H5F3O/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-5H

InChI key

NMTUHPSKJJYGML-UHFFFAOYSA-N

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General description

Aldol reaction of 3-(trifluoromethyl)benzaldehyde with hydroxyacetone in the aldolase antibody 38C2-ionic liquid system has been investigated.

Pictograms

Exclamation markEnvironment

Signal Word

Warning

Hazard Statements

Hazard Classifications

Aquatic Acute 1 - Aquatic Chronic 2 - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

10 - Combustible liquids

WGK

WGK 3

Flash Point(F)

154.4 °F - closed cup

Flash Point(C)

68 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Synthesis of fluorinated materials catalyzed by proline or antibody 38C2 in ionic liquid.
Kitazume T, et al.
Journal of Fluorine Chemistry, 121(2), 205-212 (2003)

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