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Isobutyl (p-Tolyl) Sulfide
[CAS# 54576-37-3]

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CAS#: 54576-37-3
Product: Isobutyl (p-Tolyl) Sulfide
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Identification
Name Isobutyl (p-Tolyl) Sulfide
Synonyms 1-Isobutylsulfanyl-4-Methyl-Benzene; 1-(Isobutylthio)-4-Methylbenzene; 1-(Isobutylthio)-4-Methyl-Benzene
Molecular Structure CAS#: 54576-37-3, Isobutyl (p-Tolyl) Sulfide
Molecular Formula C11H16S
Molecular Weight 180.31
CAS Registry Number 54576-37-3
SMILES C1=CC(=CC=C1SCC(C)C)C
InChI 1S/C11H16S/c1-9(2)8-12-11-6-4-10(3)5-7-11/h4-7,9H,8H2,1-3H3
InChIKey DLVHVWLLAJMHDY-UHFFFAOYSA-N
Properties
Density 0.967g/cm3 (Cal.)
Boiling point 252.418°C at 760 mmHg (Cal.)
Flash point 104.453°C (Cal.)
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