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4-Methoxyphenylacetonitrile

ALDRICH/169986 - 97%

Synonym: 4-Methoxybenzyl cyanide

CAS Number: 104-47-2
Empirical Formula (Hill Notation): C9H9NO
Molecular Weight: 147.17
EC Number: 203-206-0
MDL Number: MFCD00001919
Linear Formula: CH3OC6H4CH2CN
Product Type: Chemical
Catalog Number PKG Qty. Price Quantity
45-169986-25G 25 g
 $0.00
1/EA
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45-169986-100G 100 g
 $83.30
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assay 97%
bp 286-287 °C (lit.)
density 1.085 g/mL at 25 °C (lit.)
functional group nitrile
InChI 1S/C9H9NO/c1-11-9-4-2-8(3-5-9)6-7-10/h2-5H,6H2,1H3
InChI key PACGLQCRGWFBJH-UHFFFAOYSA-N
Quality Level 200 
refractive index n20/D 1.531 (lit.)
SMILES string COc1ccc(CC#N)cc1
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
General description: 4-Methoxyphenylacetonitrile has been isolated from the sponge Psammaplysilla purpurea.
Packaging: 25, 100 g in glass bottle
Symbol GHS06  GHS06
Signal word Danger
Hazard statements H301 - H412
Precautionary statements P273 - P301 + P310 + P330
Hazard Codes T
Risk Statements 25-52/53
Safety Statements 45-61
RIDADR UN 3276 6.1 / PGIII
WGK Germany WGK 3
Flash Point(F) 242.6 °F - DIN 51758
Flash Point(C) 117 °C - DIN 51758
Purity 97%
bp 286-287 °C (lit.)
Density 1.085 g/mL at 25 °C (lit.)
Refractive Index n20/D 1.531 (lit.)
UNSPSC 12352100

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