chempirical

5-Bromo-2-iodo-3-methoxypyrazine

C5H4BrIN2OCAS 476622-89-6314.91 g/mol

Open in Covalent MOL file
ONNIBr
Aryl halideEther

Properties

Molecular formula
C5H4BrIN2O
Molar mass
314.91 g/mol
Exact mass
313.8552 Da
logP
1.85Crippen estimate
Polar surface area
35.0 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
1

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
476622-89-6
SMILES
COC1=NC(=CN=C1I)Br
InChIKey
NUOPFUYHRPYSNY-UHFFFAOYSA-N
InChI
InChI=1S/C5H4BrIN2O/c1-10-5-4(7)8-2-3(6)9-5/h2H,1H3

Weigh it out

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

Work with 5-Bromo-2-iodo-3-methoxypyrazine

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-bromo-3-methoxypyrazine5900-13-061 % similar 6-Bromo-2-methoxy-3-pyridinamine89466-18-246 % similar 2-Bromo-5-methoxypyrazine143250-10-645 % similar 5-Bromo-3-iodo-2-methoxypyridine578007-66-643 % similar 5-Iodo-2,4-dimethoxypyrimidine52522-99-342 % similar 5-Bromo-2,4-dimethoxypyrimidine56686-16-942 % similar 5-Bromo-2-chloro-4-methoxypyrimidine57054-92-941 % similar 5-Bromo-2-methoxy-3-methylpyridine760207-87-241 % similar

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

Elsewhere

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