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180645

Sigma-Aldrich

2-Methoxyphenylacetonitrile

98%

Synonym(s):
2-Methoxybenzyl cyanide
Linear Formula:
CH3OC6H4CH2CN
CAS Number:
Molecular Weight:
147.17
Beilstein:
2087748
EC Number:
MDL number:
PubChem Substance ID:

Quality Level

assay

98%

form

crystals

bp

143 °C/15 mmHg (lit.)

mp

65-67 °C (lit.)

SMILES string

COc1ccccc1CC#N

InChI

1S/C9H9NO/c1-11-9-5-3-2-4-8(9)6-7-10/h2-5H,6H2,1H3

InChI key

DWJKILXTMUGXOU-UHFFFAOYSA-N

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Application

2-Methoxyphenylacetonitrile was used in the synthesis of 2-(1-cyano-1-(2-methoxy)phenyl)methylidene-3-phenylthiazolidine-4,5-dione.

Packaging

50 g in glass bottle

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Precautionary Statements

Hazard Classifications

Eye Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

264.2 °F - DIN 51758

Flash Point(C)

129 °C - DIN 51758

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificate of Analysis

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Certificate of Origin

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Uwe Albrecht et al.
Bioorganic & medicinal chemistry, 13(14), 4402-4407 (2005-05-21)
2-Alkylidenethiazolidine-4,5-diones were prepared by novel one-pot cyclizations of arylacetonitriles with isothiocyanates and ethyl 2-chloro-2-oxoacetate. The products show antibiotic activity against the Gram-positive bacteria Bacillus subtilis and Staphylococcus aureus.

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