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Erucin
[CAS# 4430-36-8]

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Identification
Name Erucin
Synonyms 1-Isothiocyanato-4-Methylsulfanyl-Butane; 1-Isothiocyanato-4-(Methylthio)Butane; 4-(Methylthio)Butyl Isothiocyanate
Molecular Structure CAS#: 4430-36-8, Erucin
Molecular Formula C6H11NS2
Molecular Weight 161.28
CAS Registry Number 4430-36-8
SMILES S=C=NCCCCSC
InChI 1S/C6H11NS2/c1-9-5-3-2-4-7-6-8/h2-5H2,1H3
InChIKey IHQDGXUYTSZGOG-UHFFFAOYSA-N
Properties
Density 1.035g/cm3 (Cal.)
Boiling point 250.594°C at 760 mmHg (Cal.)
Flash point 105.356°C (Cal.)
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