2-Bromo-4-methoxyphenol

C7H7BrO2CAS 17332-11-5203.03 g/mol

Open in Covalent MOL file
OOHBr
Aryl halideEtherPhenol

Properties

Molecular formula
C7H7BrO2
Molar mass
203.03 g/mol
Exact mass
201.9629 Da
Melting point
77–78 °C
Boiling point
146 °C (at 30 Torr)
logP
2.16Crippen estimate
Polar surface area
29.5 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
1

Hazards

Warning
Irritant (GHS07)

Aggregated from 4 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
17332-11-5
SMILES
COc1ccc(O)c(Br)c1
InChIKey
LTMSUXSPKZRMAB-UHFFFAOYSA-N
InChI
InChI=1S/C7H7BrO2/c1-10-5-2-3-7(9)6(8)4-5/h2-4,9H,1H3

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Names and synonyms

3 names
  • Phenol, 2-bromo-4-methoxy-
  • NSC 168509
  • 2-Bromo-4-methoxybenzenol

Work with 2-Bromo-4-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

2-Chloro-4-methoxyphenol18113-03-661 % similar 1-Bromo-2,5-dimethoxybenzene25245-34-560 % similar 2-Amino-4-methoxyphenol20734-76-358 % similar 4-Methoxy-2-methylphenol5307-05-158 % similar 3-Bromo-4-fluoroanisole1161497-23-956 % similar 2-Fluoro-4-methoxyphenol167683-93-456 % similar 3-Bromo-4-chloroanisole2732-80-156 % similar 2-Bromo-1-iodo-4-methoxybenzene466639-53-256 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromo-3-methoxyphenol102127-34-4 5-Bromo-2-hydroxybenzyl alcohol2316-64-5 2-Bromo-5-(hydroxymethyl)phenol2737-19-1 3-Bromo-4-hydroxybenzenemethanol29922-56-3 5-Bromo-2-methoxyphenol37942-01-1 2-Bromo-5-methoxyphenol63604-94-4 4-Bromo-2-methoxyphenol7368-78-7

Elsewhere

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