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2-Isopropyl-5-methylbenzonitrile
[CAS# 91131-81-6]

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Identification
Name 2-Isopropyl-5-methylbenzonitrile
Synonyms 2-isopropyl-5-methylbenzonitrile
Molecular Structure CAS#: 91131-81-6, 2-Isopropyl-5-methylbenzonitrile
Molecular Formula C11H13N
Molecular Weight 159.23
CAS Registry Number 91131-81-6
SMILES Cc1ccc(c(c1)C#N)C(C)C
InChI 1S/C11H13N/c1-8(2)11-5-4-9(3)6-10(11)7-12/h4-6,8H,1-3H3
InChIKey AMZUJLOTAXYCLD-UHFFFAOYSA-N
Properties
Density 0.96g/cm3 (Cal.)
Boiling point 267.752°C at 760 mmHg (Cal.)
Flash point 115.888°C (Cal.)
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