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4-Isopropyl-3,5-dimethylbenzonitrile
[CAS# 90877-62-6]

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Identification
Name 4-Isopropyl-3,5-dimethylbenzonitrile
Synonyms 4-isopropyl-3,5-dimethylbenzonitrile
Molecular Structure CAS#: 90877-62-6, 4-Isopropyl-3,5-dimethylbenzonitrile
Molecular Formula C12H15N
Molecular Weight 173.25
CAS Registry Number 90877-62-6
SMILES Cc1cc(cc(c1C(C)C)C)C#N
InChI 1S/C12H15N/c1-8(2)12-9(3)5-11(7-13)6-10(12)4/h5-6,8H,1-4H3
InChIKey QDXHTJVNPSJFHC-UHFFFAOYSA-N
Properties
Density 0.953g/cm3 (Cal.)
Boiling point 288.732°C at 760 mmHg (Cal.)
Flash point 128.747°C (Cal.)
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