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5-Bromovanillic Acid
[CAS# 6324-52-3]

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Identification
Name 5-Bromovanillic Acid
Synonyms 3-Bromo-4-Hydroxy-5-Methoxy-Benzoic Acid; Benzoic Acid, 3-Bromo-4-Hydroxy-5-Methoxy-; Nsc29084
Molecular Structure CAS#: 6324-52-3, 5-Bromovanillic Acid
Molecular Formula C8H7BrO4
Molecular Weight 247.04
CAS Registry Number 6324-52-3
EINECS 228-685-3
SMILES C1=C(C(=O)O)C=C(C(=C1Br)O)OC
InChI 1S/C8H7BrO4/c1-13-6-3-4(8(11)12)2-5(9)7(6)10/h2-3,10H,1H3,(H,11,12)
InChIKey FGOVBTMEPVEFCJ-UHFFFAOYSA-N
Properties
Density 1.757g/cm3 (Cal.)
Boiling point 352.013°C at 760 mmHg (Cal.)
Flash point 166.692°C (Cal.)
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