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CAS Number: 914637-31-3
2-(3-fluoro-5-methoxyphenyl)acetonitrile

Structure

2-(3-fluoro-5-methoxyphenyl)acetonitrile
Name: 2-(3-fluoro-5-methoxyphenyl)acetonitrile
Synonyms:
General Information
Product Number: 914637313
CAS Registry Number: 
914637-31-3
Name:
Benzeneacetonitrile, 3-fluoro-5-methoxy-
(3-Fluoro-5-methoxyphenyl)acetonitrile; 2-(3-Fluoro-5-methoxyphenyl)acetonitrile 
 
Chemical Formula: C9H8FNO
Exact Mass: 165.06
Molecular Weight: 165.16
m/z: 165.06 (100.0%), 166.06 (10.1%)
Elemental Analysis: C, 65.45; H, 4.88; F, 11.50; N, 8.48; O, 9.69
 
InChI: InChI=1S/C9H8FNO/c1-12-9-5-7(2-3-11)4-8(10)6-9/h4-6H,2H2,1H3
InChIKey: VWYCYRCMXIAREJ-UHFFFAOYSA-N
Canonical SMILES : COC1=CC(=CC(=C1)CC#N)F

Specification

98%

References

PCT Int. Appl. (2012), WO 2012039371 A1 20120329. 

PCT Int. Appl. (2011), WO 2011156518 A2 20111215.

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