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5-Bromo-8H-1,3-Dioxa-8-Aza-(aS)-Indacene-7-Carboxylic Acid
[CAS# 887360-42-1]

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Identification
Name 5-Bromo-8H-1,3-Dioxa-8-Aza-(aS)-Indacene-7-Carboxylic Acid
Synonyms Bbv-004356; 5-Bromo-8H-1,3-Dioxa-8-Aza-As-Indacene-7-Carboxylic Acid; Fs015016
Molecular Structure CAS#: 887360-42-1, 5-Bromo-8H-1,3-Dioxa-8-Aza-(aS)-Indacene-7-Carboxylic Acid
Molecular Formula C10H6BrNO4
Molecular Weight 284.07
CAS Registry Number 887360-42-1
SMILES C1=C([NH]C2=C1C(=CC3=C2OCO3)Br)C(=O)O
InChI 1S/C10H6BrNO4/c11-5-2-7-9(16-3-15-7)8-4(5)1-6(12-8)10(13)14/h1-2,12H,3H2,(H,13,14)
InChIKey VALNZNRTASOLCX-UHFFFAOYSA-N
Properties
Density 2.004g/cm3 (Cal.)
Boiling point 532.505°C at 760 mmHg (Cal.)
Flash point 275.849°C (Cal.)
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