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5-Methoxy-2,1,3-Benzoxadiazole 1-Oxide
[CAS# 7791-49-3]

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Identification
Name 5-Methoxy-2,1,3-Benzoxadiazole 1-Oxide
Synonyms 5-Methoxy-1-Oxido-Benzofurazan-1-Ium; Nsc270352; 5-Methoxybenzofurazan, 1-Oxide
Molecular Structure CAS#: 7791-49-3, 5-Methoxy-2,1,3-Benzoxadiazole 1-Oxide
Molecular Formula C7H6N2O3
Molecular Weight 166.14
CAS Registry Number 7791-49-3
SMILES C1=C(C=CC2=[N+](ON=C12)[O-])OC
InChI 1S/C7H6N2O3/c1-11-5-2-3-7-6(4-5)8-12-9(7)10/h2-4H,1H3
InChIKey ABSKHUSUHODMEL-UHFFFAOYSA-N
Properties
Density 1.5±0.1g/cm3 (Cal.)
Melting point 115-118°C (Expl.)
Boiling point 291.2±32.0°C at 760 mmHg (Cal.)
Flash point 129.9±25.1°C (Cal.)
Safety Data
Safety Description CAUTION: May irritate eyes, skin, and respiratory tract
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