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4-Methoxy-3-[(1E)-3-Oxo-1-Propen-1-Yl]Benzonitrile
[CAS# 337520-38-4]

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Identification
Name 4-Methoxy-3-[(1E)-3-Oxo-1-Propen-1-Yl]Benzonitrile
Synonyms (E)-4-methoxy-3-(3-oxoprop-1-en-1-yl)benzonitrile
Molecular Structure CAS#: 337520-38-4, 4-Methoxy-3-[(1E)-3-Oxo-1-Propen-1-Yl]Benzonitrile
Molecular Formula C11H9NO2
Molecular Weight 187.19
CAS Registry Number 337520-38-4
SMILES COc1ccc(cc1/C=C/C=O)C#N
InChI 1S/C11H9NO2/c1-14-11-5-4-9(8-12)7-10(11)3-2-6-13/h2-7H,1H3/b3-2+
InChIKey LDXRYXDTHXXVHF-NSCUHMNNSA-N
Properties
Density 1.155g/cm3 (Cal.)
Boiling point 377.339°C at 760 mmHg (Cal.)
Flash point 165.048°C (Cal.)
Refractive index 1.552 (Cal.)
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