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The molecular formula of 4-Bromo-5-nitro-2-thiophenecarboxaldehyde is C5H2BrNO3S.
The molecular weight of 4-Bromo-5-nitro-2-thiophenecarboxaldehyde is 236.05 g/mol.
The compound was created on December 5, 2007.
The compound was last modified on December 2, 2023.
The IUPAC name of 4-Bromo-5-nitro-2-thiophenecarboxaldehyde is 4-bromo-5-nitrothiophene-2-carbaldehyde.
The InChI of 4-Bromo-5-nitro-2-thiophenecarboxaldehyde is InChI=1S/C5H2BrNO3S/c6-4-1-3(2-8)11-5(4)7(9)10/h1-2H.
The InChIKey of 4-Bromo-5-nitro-2-thiophenecarboxaldehyde is VVTSZQWGTDZBFV-UHFFFAOYSA-N.
The canonical SMILES representation of 4-Bromo-5-nitro-2-thiophenecarboxaldehyde is C1=C(SC(=C1Br)[N+](=O)[O-])C=O.
The XLogP3-AA value of 4-Bromo-5-nitro-2-thiophenecarboxaldehyde is 2.3.
4-Bromo-5-nitro-2-thiophenecarboxaldehyde has 4 hydrogen bond acceptor counts.
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