4-Bromo-3-methoxyphenol

C₇H₇BrO₂CAS 102127-34-4203.03 g/mol

Open in Covalent MOL file

Aryl halide Ether Phenol

Properties

Molecular formula: C₇H₇BrO₂
Molar mass: 203.03 g/mol
Exact mass: 201.9629 Da
logP: 2.16Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 1

Identifiers

CAS number

102127-34-4

SMILES

COC1=C(C=CC(=C1)O)Br

InChIKey

UYDZUCNMZXCLJI-UHFFFAOYSA-N

InChI

InChI=1S/C7H7BrO2/c1-10-7-4-5(9)2-3-6(7)8/h2-4,9H,1H3

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with 4-Bromo-3-methoxyphenol

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-Dimethoxyphenol2033-89-864 % similar 1-Bromo-2,4-dimethoxybenzene17715-69-460 % similar 2-Methoxyhydroquinone824-46-460 % similar 1-Bromo-4-chloro-2-methoxybenzene174913-09-856 % similar 2-Bromoanisole578-57-452 % similar 3-Amino-4-bromophenol100367-37-152 % similar 4-Bromo-3-methylphenol14472-14-152 % similar 3-Fluoro-4-methoxyphenol452-11-952 % similar

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

Same formula

2-Bromo-4-methoxyphenol17332-11-5 5-Bromo-2-hydroxybenzyl alcohol2316-64-5 3-Bromo-4-hydroxybenzenemethanol29922-56-3 5-Bromo-2-methoxyphenol37942-01-1 2-Bromo-5-methoxyphenol63604-94-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook