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Ethyl 2-isothiocyanato-4,5-dimethyl-3-thiophenecarboxylate
[CAS# 85716-85-4]

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Identification
Name Ethyl 2-isothiocyanato-4,5-dimethyl-3-thiophenecarboxylate
Synonyms ETHYL2-ISOTHIOCYANATO-4,5-DIMETHYLTHIOPHENE-3-CARBOXYLATE; MFCD04969625
Molecular Structure CAS#: 85716-85-4, Ethyl 2-isothiocyanato-4,5-dimethyl-3-thiophenecarboxylate
Molecular Formula C10H11NO2S2
Molecular Weight 241.33
CAS Registry Number 85716-85-4
SMILES S=C=N/c1sc(c(c1C(=O)OCC)C)C
InChI 1S/C10H11NO2S2/c1-4-13-10(12)8-6(2)7(3)15-9(8)11-5-14/h4H2,1-3H3
InChIKey ONDWCCQQWAIQRH-UHFFFAOYSA-N
Properties
Density 1.243g/cm3 (Cal.)
Boiling point 384.269°C at 760 mmHg (Cal.)
Flash point 186.199°C (Cal.)
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