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Quality Level
Assay
97%
refractive index
n20/D 1.531 (lit.)
bp
286-287 °C (lit.)
density
1.085 g/mL at 25 °C (lit.)
SMILES string
COc1ccc(CC#N)cc1
InChI
1S/C9H9NO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6H2,1H3
InChI key
PACGLQCRGWFBJH-UHFFFAOYSA-N
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General description
4-Methoxyphenylacetonitrile has been isolated from the sponge Psammaplysilla purpurea.
Application
4-Methoxyphenylacetonitrile was used as starting reagent in the synthesis of :
- 2-(1-cyano-1-(2-methoxy)phenyl)methylidene-3-phenylthiazolidine-4,5-dione
- 2-(1-cyano-1-(4-methoxy)-phenyl)methylidene-3-phenylthiazolidine-4,5-dione
- α-cyanostilbenes
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Acute Tox. 3 Oral - Aquatic Chronic 3
WGK
WGK 3
Flash Point(F)
242.6 °F
Flash Point(C)
117 °C
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Brominated benzeneacetonitriles, the dibromotyrosine metabolites from the sponge Psammaplysilla purpurea.
Journal of Natural Products, 58(7), 1087-1088 (1995)
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.
Photochemistry and photobiology, 97(2), 289-300 (2020-10-02)
Developing effective and low-cost organic hole-transporting materials (HTMs) is crucial for the construction of high-performance perovskite solar cells (PSCs) and to promote their production in commercial ventures. In this context, we herein report the molecular design, synthesis and characterization of
Bioorganic & medicinal chemistry, 17(9), 3479-3488 (2009-04-11)
We have investigated halogen-substituted non-steroidal estrogens with selective binding affinity for the estrogen receptor beta (ERbeta that might be used for imaging the levels of this ER-subtype in breast tumors by positron emission tomography (PET). Based on diarylpropionitrile (DPN, 1a)
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