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5-Isopropyl-2-methoxybenzonitrile
[CAS# 85902-69-8]

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Identification
Name 5-Isopropyl-2-methoxybenzonitrile
Synonyms 5-isopropyl-2-methoxybenzonitrile; 5-Isopropyl-2-methoxy-benzonitrile
Molecular Structure CAS#: 85902-69-8, 5-Isopropyl-2-methoxybenzonitrile
Molecular Formula C11H13NO
Molecular Weight 175.23
CAS Registry Number 85902-69-8
SMILES CC(C)c1ccc(c(c1)C#N)OC
InChI 1S/C11H13NO/c1-8(2)9-4-5-11(13-3)10(6-9)7-12/h4-6,8H,1-3H3
InChIKey WMGQXXIBRBJBMT-UHFFFAOYSA-N
Properties
Density 1.018g/cm3 (Cal.)
Boiling point 276.237°C at 760 mmHg (Cal.)
Flash point 115.941°C (Cal.)
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