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4-(4-Pyrimidinyl)benzonitrile
[CAS# 879063-33-9]

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Identification
Name 4-(4-Pyrimidinyl)benzonitrile
Synonyms 4-(4-CYANOPHENYL)PYRIMIDINE; 4-(pyrimidin-4-yl)benzonitrile
Molecular Structure CAS#: 879063-33-9, 4-(4-Pyrimidinyl)benzonitrile
Molecular Formula C11H7N3
Molecular Weight 181.19
CAS Registry Number 879063-33-9
SMILES N#Cc2ccc(c1ncncc1)cc2
InChI 1S/C11H7N3/c12-7-9-1-3-10(4-2-9)11-5-6-13-8-14-11/h1-6,8H
InChIKey IMYDLNZNWSZZKO-UHFFFAOYSA-N
Properties
Density 1.24g/cm3 (Cal.)
Boiling point 374.297°C at 760 mmHg (Cal.)
Flash point 127.601°C (Cal.)
Refractive index 1.625 (Cal.)
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