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1-[(6-Nitro-1,3-Benzothiazol-2-Yl)Sulfanyl]Acetone
[CAS# 532951-91-0]

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Identification
Name 1-[(6-Nitro-1,3-Benzothiazol-2-Yl)Sulfanyl]Acetone
Synonyms 1-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]propan-2-one; 1-[(6-nitro-1,3-benzothiazol-2-yl)thio]acetone; MFCD03356976
Molecular Structure CAS#: 532951-91-0, 1-[(6-Nitro-1,3-Benzothiazol-2-Yl)Sulfanyl]Acetone
Molecular Formula C10H8N2O3S2
Molecular Weight 268.31
CAS Registry Number 532951-91-0
SMILES [O-][N+](=O)c1ccc2nc(SCC(=O)C)sc2c1
InChI 1S/C10H8N2O3S2/c1-6(13)5-16-10-11-8-3-2-7(12(14)15)4-9(8)17-10/h2-4H,5H2,1H3
InChIKey OCUJHKVWCDVONX-UHFFFAOYSA-N
Properties
Density 1.498g/cm3 (Cal.)
Boiling point 440.446°C at 760 mmHg (Cal.)
Flash point 220.174°C (Cal.)
Refractive index 1.688 (Cal.)
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