1-Bromo-4-methoxy-2-nitrobenzene

C₇H₆BrNO₃CAS 5344-78-5232.03 g/mol

Open in Covalent MOL file

Aryl halide Ether Nitro

Properties

Molecular formula: C₇H₆BrNO₃
Molar mass: 232.03 g/mol
Exact mass: 230.9531 Da
Melting point: 32 °C
Boiling point: 153–154 °C (at 13 Torr)
logP: 2.37Crippen estimate
Polar surface area: 52.4 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 2

Identifiers

CAS number

5344-78-5

SMILES

COc1ccc(Br)c([N+](=O)[O-])c1

InChIKey

KCOBIBRGPCFIGF-UHFFFAOYSA-N

InChI

InChI=1S/C7H6BrNO3/c1-12-5-2-3-6(8)7(4-5)9(10)11/h2-4H,1H3

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Names and synonyms

8 names

Benzene, 1-bromo-4-methoxy-2-nitro-
Anisole, 4-bromo-3-nitro-
4-Methoxy-2-nitrobromobenzene
4-Bromo-3-nitroanisole
2-Bromo-5-methoxynitrobenzene
2-Bromo-5-methoxy-1-nitrobenzene
NSC 1161
1-Bromo-2-nitro-4-methoxybenzene

Work with 1-Bromo-4-methoxy-2-nitrobenzene

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Same formula

4-Bromo-2-methoxy-1-nitrobenzene103966-66-1 4-Bromo-3,5-dihydroxybenzamide13429-12-4 1-Bromo-3-methoxy-5-nitrobenzene16618-67-0 4-Bromo-1-methoxy-2-nitrobenzene33696-00-3 2-Bromo-1-methoxy-4-nitrobenzene5197-28-4 5-Bromo-2-methoxy-3-pyridinecarboxylic acid54916-66-4 2-Hydroxy-5-nitrobenzyl bromide772-33-8 1-Bromo-2-methoxy-4-nitrobenzene77337-82-7

Elsewhere

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