5-Bromo-4,6-dihydroxypyrimidine

C₄H₃BrN₂O₂CAS 15726-38-2190.98 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₄H₃BrN₂O₂
Molar mass: 190.98 g/mol
Exact mass: 189.9378 Da
logP: 0.24Crippen estimate
Polar surface area: 66.0 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 0

Identifiers

CAS number

15726-38-2

SMILES

C1=NC(=C(C(=O)N1)Br)O

InChIKey

XVXHFPZMRQXGBM-UHFFFAOYSA-N

InChI

InChI=1S/C4H3BrN2O2/c5-2-3(8)6-1-7-4(2)9/h1H,(H2,6,7,8,9)

Weigh it out

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

Work with 5-Bromo-4,6-dihydroxypyrimidine

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

Hypoxanthine68-94-033 % similar 3-Methylxanthine1076-22-833 % similar Xanthine69-89-632 % similar 5-Bromo-2(1H)-pyrazinone374063-92-031 % similar 2-Thioxanthine2487-40-330 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

5-Bromo-1H-pyrazole-3-carboxylic acid1328893-16-8 4-Bromopyridazine-3,6-diol15456-86-7 5-Bromouracil51-20-7

Elsewhere

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