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Methyl 2-isothiocyanatobutanoate
[CAS# 68693-53-8]

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Identification
Name Methyl 2-isothiocyanatobutanoate
Synonyms Methyl DL-2-isothiocyanatobutyrate; MFCD00041109
Molecular Structure CAS#: 68693-53-8, Methyl 2-isothiocyanatobutanoate
Molecular Formula C6H9NO2S
Molecular Weight 159.21
CAS Registry Number 68693-53-8
SMILES O=C(OC)C(/N=C=S)CC
InChI 1S/C6H9NO2S/c1-3-5(7-4-10)6(8)9-2/h5H,3H2,1-2H3
InChIKey JQEICALGZPXFNA-UHFFFAOYSA-N
Properties
Density 1.103g/cm3 (Cal.)
1.11 (Expl.)
Boiling point 218.158°C at 760 mmHg (Cal.)
100°C (Expl.)
Flash point 85.74°C (Cal.)
Market Analysis Reports
List of Reports Available for Methyl 2-isothiocyanatobutanoate
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