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Home >> Chemical Listing >> Page 882 >> 5-Isothiocyanato-4-Methoxy-1,3-Benzothiazole

5-Isothiocyanato-4-Methoxy-1,3-Benzothiazole
[CAS# 208458-63-3]

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Identification
Name 5-Isothiocyanato-4-Methoxy-1,3-Benzothiazole
Synonyms 5-isothiocyanato-4-methoxybenzo[d]thiazole
Molecular Structure CAS#: 208458-63-3, 5-Isothiocyanato-4-Methoxy-1,3-Benzothiazole
Molecular Formula C9H6N2OS2
Molecular Weight 222.29
CAS Registry Number 208458-63-3
SMILES COc1c(ccc2c1ncs2)N=C=S
InChI 1S/C9H6N2OS2/c1-12-9-6(10-4-13)2-3-7-8(9)11-5-14-7/h2-3,5H,1H3
InChIKey GZUPOWBAWQTSTF-UHFFFAOYSA-N
Properties
Density 1.401g/cm3 (Cal.)
Boiling point 397.995°C at 760 mmHg (Cal.)
Flash point 194.501°C (Cal.)
Refractive index 1.701 (Cal.)
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