4-Bromo-2-methoxyphenol

C7H7BrO2CAS 7368-78-7203.03 g/mol

Open in Covalent MOL file
OBrHO
Aryl halideEtherPhenol

Properties

Molecular formula
C7H7BrO2
Molar mass
203.03 g/mol
Exact mass
201.9629 Da
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 47 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
7368-78-7
SMILES
COC1=C(C=CC(=C1)Br)O
InChIKey
WHSIIJQOEGXWSN-UHFFFAOYSA-N
InChI
InChI=1S/C7H7BrO2/c1-10-7-4-5(8)2-3-6(7)9/h2-4,9H,1H3

Weigh it out

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

Work with 4-Bromo-2-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-Methoxybenzene-1,4-diol824-46-466 % similar Bromoveratrole2859-78-164 % similar 4-Bromo-2-methoxybenzenamine59557-91-458 % similar Creosol93-51-658 % similar 4-Bromo-1-fluoro-2-methoxybenzene103291-07-256 % similar 4-Chloro-2-methoxyphenol16766-30-656 % similar 5-Bromo-2-chloroanisole16817-43-956 % similar 4-Fluoro-2-methoxyphenol450-93-156 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Bromo-3-methoxyphenol102127-34-4 2-Bromo-4-methoxyphenol17332-11-5 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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook