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Methyl 2-Isothiocyanato-4,5-Dimethyl-3-Thiophenecarboxylate
[CAS# 588676-61-3]

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Identification
Name Methyl 2-Isothiocyanato-4,5-Dimethyl-3-Thiophenecarboxylate
Synonyms methyl 2-isothiocyanato-4,5-dimethylthiophene-3-carboxylate; MFCD03943783; ZINC02522235
Molecular Structure CAS#: 588676-61-3, Methyl 2-Isothiocyanato-4,5-Dimethyl-3-Thiophenecarboxylate
Molecular Formula C9H9NO2S2
Molecular Weight 227.30
CAS Registry Number 588676-61-3
SMILES CC1=C(SC(=C1C(=O)OC)N=C=S)C
InChI 1S/C9H9NO2S2/c1-5-6(2)14-8(10-4-13)7(5)9(11)12-3/h1-3H3
InChIKey YYQIQCGIUXTUIR-UHFFFAOYSA-N
Properties
Density 1.3±0.1g/cm3 (Cal.)
Boiling point 373.3±42.0°C at 760 mmHg (Cal.)
Flash point 179.6±27.9°C (Cal.)
Refractive index 1.605 (Cal.)
Safety Data
Safety Description IRRITANT
SDS Available
Market Analysis Reports
List of Reports Available for Methyl 2-Isothiocyanato-4,5-Dimethyl-3-Thiophenecarboxylate
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