chempirical

3-Bromo-4-methoxyaniline

C7H8BrNOCAS 19056-41-8202.05 g/mol

Open in Covalent MOL file
ONH2Br
Aryl halideEtherPrimary amine

Properties

Molecular formula
C7H8BrNO
Molar mass
202.05 g/mol
Exact mass
200.9789 Da
logP
2.04Crippen estimate
Polar surface area
35.3 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
19056-41-8
SMILES
COC1=C(C=C(C=C1)N)Br
InChIKey
NMUFTXMBONJQTC-UHFFFAOYSA-N
InChI
InChI=1S/C7H8BrNO/c1-10-7-3-2-5(9)4-6(7)8/h2-4H,9H2,1H3

Weigh it out

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Work with 3-Bromo-4-methoxyaniline

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

Similar compounds

3,4-Dimethoxyaniline6315-89-564 % similar 2,4-Diaminoanisole615-05-462 % similar 2,4-Dibromoanisole21702-84-160 % similar 1-Bromo-2,5-dimethoxybenzene25245-34-560 % similar 2-Bromo-4-methylanisole22002-45-558 % similar 5-Amino-2-methoxyphenol1687-53-256 % similar 3-Fluoro-4-methoxyaniline366-99-456 % similar 2-Bromo-4-fluoro-1-methoxybenzene452-08-456 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Bromo-3-methoxy-2-methylpyridine1150617-80-3 2-Amino-6-bromoanisole116557-46-1 5-Bromo-2-methoxy-6-picoline126717-59-7 5-Bromo-2-methoxy-4-methylpyridine164513-39-7 4-Bromo-3-methoxyaniline19056-40-7 5-Bromo-2-ethoxypyridine55849-30-4 3-Bromo-2-ethoxypyridine57883-25-7 4-Bromo-2-methoxybenzenamine59557-91-4

Elsewhere

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