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Methyl 4-bromo-3-nitrobenzoate

Catalog Number ACM2363168
CAS Number 2363-16-8
Synonyms 2-Bromo-5-(methoxycarbonyl)nitrobenzene
IUPAC Name methyl 4-bromo-3-nitrobenzoate
Molecular Weight 260.04
Molecular Formula C8H6BrNO4
Canonical SMILES COC(=O)C1=CC(=C(C=C1)Br)[N+](=O)[O-]
InChI InChI=1S/C8H6BrNO4/c1-14-8(11)5-2-3-6(9)7(4-5)10(12)13/h2-4H,1H3
InChI Key BNNDHGPPQZVKMX-UHFFFAOYSA-N
Boiling Point 320.9±22.0 ºC
Melting Point 102-103 ºC
Purity 98%+
Density 1.673±0.06 g/ml