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526622

Sigma-Aldrich

6-Chloro-2-fluoro-3-methylbenzaldehyde

98%

Synonym(s):

6-Chloro-2-fluoro-m-tolualdehyde

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About This Item

Linear Formula:
ClC6H2(F)(CH3)CHO
CAS Number:
286474-59-7
Molecular Weight:
172.58
MDL number:
MFCD01631370
UNSPSC Code:
12352100
PubChem Substance ID:
24874565
NACRES:
NA.22

assay

98%

refractive index

n20/D 1.548 (lit.)

bp

249 °C (lit.)

density

1.3 g/mL at 25 °C (lit.)

SMILES string

Cc1ccc(Cl)c(C=O)c1F

InChI

1S/C8H6ClFO/c1-5-2-3-7(9)6(4-11)8(5)10/h2-4H,1H3

InChI key

GGZOMBUJFMOEEZ-UHFFFAOYSA-N

General description

6-Chloro-2-fluoro-3-methylbenzaldehyde is also referred to as 6-chloro-2-fluoro-m-tolualdehyde. Toxicity of 6-Chloro-2-fluoro-3-methylbenzaldehyde in Tetrahymena pyriformis was established by developing a quantitative structure-activity relationship (QSAR) model.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

10 - Combustible liquids

wgk_germany

WGK 3

flash_point_f

230.0 °F - closed cup

flash_point_c

110 °C - closed cup

ppe

Eyeshields, Gloves, type ABEK (EN14387) respirator filter

Certificates of Analysis (COA)

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QSAR modeling of aquatic toxicity of aromatic aldehydes using artificial neural network (ANN) and multiple linear regression (MLR).
Louis B and Agrawal VK.
J. Ind. Chem. Soc., 88(1), 99-99 (2011)

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