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Home >> Chemical Listing >> Page 222 >> 6-Isothiocyanato-5-Methoxy-1,3-Benzothiazole

6-Isothiocyanato-5-Methoxy-1,3-Benzothiazole
[CAS# 120195-00-8]

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Identification
Name 6-Isothiocyanato-5-Methoxy-1,3-Benzothiazole
Synonyms 6-isothiocyanato-5-methoxybenzo[d]thiazole
Molecular Structure CAS#: 120195-00-8, 6-Isothiocyanato-5-Methoxy-1,3-Benzothiazole
Molecular Formula C9H6N2OS2
Molecular Weight 222.29
CAS Registry Number 120195-00-8
SMILES COc1cc2c(cc1N=C=S)scn2
InChI 1S/C9H6N2OS2/c1-12-8-2-7-9(14-5-11-7)3-6(8)10-4-13/h2-3,5H,1H3
InChIKey DMWJVEDGGQGGDR-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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