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Home >> Chemical Listing >> Page 2664 >> 3-Methyl-5-nitro-1,3-benzothiazol-2(3H)-one

3-Methyl-5-nitro-1,3-benzothiazol-2(3H)-one
[CAS# 813424-06-5]

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Identification
Name 3-Methyl-5-nitro-1,3-benzothiazol-2(3H)-one
Synonyms 3-methyl-5-nitrobenzo[d]thiazol-2(3H)-one
Molecular Structure CAS#: 813424-06-5, 3-Methyl-5-nitro-1,3-benzothiazol-2(3H)-one
Molecular Formula C8H6N2O3S
Molecular Weight 210.21
CAS Registry Number 813424-06-5
SMILES O=N(=O)c1cc2c(cc1)SC(=O)N2C
InChI 1S/C8H6N2O3S/c1-9-6-4-5(10(12)13)2-3-7(6)14-8(9)11/h2-4H,1H3
InChIKey OUMDRCNQXVDBNU-UHFFFAOYSA-N
Properties
Density 1.53g/cm3 (Cal.)
Boiling point 394.795°C at 760 mmHg (Cal.)
Flash point 192.565°C (Cal.)
Refractive index 1.686 (Cal.)
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