4-Amino-2-bromophenol

C6H6BrNOCAS 16750-67-7188.02 g/mol

Open in Covalent MOL file
H2NOHBr
Aryl halidePhenolPrimary amine

Properties

Molecular formula
C6H6BrNO
Molar mass
188.02 g/mol
Exact mass
186.9633 Da
Melting point
165 °C
logP
1.74Crippen estimate
Polar surface area
46.3 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Hazards

Warning
Irritant (GHS07)

Aggregated from 41 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P270, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P337+P317, P362+P364, P501

Identifiers

CAS number
16750-67-7
SMILES
Nc1ccc(O)c(Br)c1
InChIKey
CBQJZWGBFZAUEV-UHFFFAOYSA-N
InChI
InChI=1S/C6H6BrNO/c7-5-3-4(8)1-2-6(5)9/h1-3,9H,8H2

Weigh it out

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Names and synonyms

2 names
  • Phenol, 4-amino-2-bromo-
  • 2-Bromo-4-aminophenol

Work with 4-Amino-2-bromophenol

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-Dibromobenzenamine615-55-460 % similar 4-Amino-2,6-dibromophenol609-21-258 % similar 4-Amino-2-chlorophenol3964-52-157 % similar 2-Bromo-1,4-benzenediol583-69-756 % similar 2,4-Dibromophenol615-58-756 % similar 5-Amino-2-hydroxytoluene2635-95-252 % similar 4-Amino-2-methylphenol2835-96-352 % similar 4-Amino-2-fluorophenol399-96-252 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

3-Amino-4-bromophenol100367-37-1 4-Bromo-2-methoxypyridine100367-39-3 2-Bromo-5-methoxypyridine105170-27-2 2-Amino-3-bromophenol116435-77-9 (2-Bromopyridin-4-yl)methanol118289-16-0 (6-Bromo-pyridin-3-yl)-methanol122306-01-8 4-Bromo-2-pyridinemethanol131747-45-0 3-Bromo-2-methoxypyridine13472-59-8

Elsewhere

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