2-Amino-4-bromophenol

C₆H₆BrNOCAS 40925-68-6188.02 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
logP: 1.74Crippen estimate
Polar surface area: 46.3 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

40925-68-6

SMILES

C1=CC(=C(C=C1Br)N)O

InChIKey

JHRIPENGTGSNPJ-UHFFFAOYSA-N

InChI

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

Weigh it out

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

Work with 2-Amino-4-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-5-bromophenol38191-34-369 % similar 4-Bromobenzene-1,2-diamine1575-37-760 % similar 4-Bromocatechol17345-77-660 % similar 4,4'-Dibromobiphenyl-2,2'-diamine136630-36-958 % similar 2,5-Dibromoaniline3638-73-156 % similar 2,4-Dibromophenol615-58-756 % similar 4-Bromo-2-chlorophenol3964-56-554 % similar 4-Bromo-2-iodophenol207115-22-852 % 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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