2-Amino-5-bromophenol

C₆H₆BrNOCAS 38191-34-3188.02 g/mol

Open in Covalent MOL file

Aryl halide Phenol Primary amine

Properties

Molecular formula: C₆H₆BrNO
Molar mass: 188.02 g/mol
Exact mass: 186.9633 Da
Melting point: 146–147 °C
logP: 1.74Crippen estimate
Polar surface area: 46.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

Warning

H302+H312+H332 Harmful if swallowed, in contact with skin or if inhaled25% of notifiers
H302 Harmful if swallowed50% of notifiers
H315 Causes skin irritation50% of notifiers
H317 May cause an allergic skin reaction25% of notifiers
H319 Causes serious eye irritation50% of notifiers
H335 May cause respiratory irritation50% of notifiers

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

Precautionary statements

P261, P264, P264+P265, P270, P271, P272, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

38191-34-3

SMILES

Nc1ccc(Br)cc1O

InChIKey

DRQWUAAWZFIVTF-UHFFFAOYSA-N

InChI

InChI=1S/C6H6BrNO/c7-4-1-2-5(8)6(9)3-4/h1-3,9H,8H2

Weigh it out

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

Names and synonyms

3 names

Phenol, 2-amino-5-bromo-
4-Bromo-2-hydroxyaniline
5-Bromo-2-aminophenol

Work with 2-Amino-5-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

2-Amino-4-bromophenol40925-68-669 % similar 4-Bromobenzene-1,2-diamine1575-37-760 % similar 4-Bromocatechol17345-77-660 % similar 3,3′-Dihydroxy-4,4′-diaminobiphenyl2373-98-058 % similar 2,4-Dibromoaniline615-57-656 % similar 4-Aminobenzene-1,3-diol hydrochloride34781-86-755 % similar 4,4'-Dibromobiphenyl-2,2'-diamine136630-36-952 % similar 5-Bromo-2-fluorophenol112204-58-752 % 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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