2-Bromo-4-methylpyrimidine

C5H5BrN2CAS 130645-48-6173.01 g/mol

Open in Covalent MOL file
NNBr
Aryl halide

Properties

Molecular formula
C5H5BrN2
Molar mass
173.01 g/mol
Exact mass
171.9636 Da
logP
1.55Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Hazards

Danger
Corrosive (GHS05)Irritant (GHS07)

Aggregated from 40 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
130645-48-6
SMILES
CC1=NC(=NC=C1)Br
InChIKey
UZIJEBOLOXOVFY-UHFFFAOYSA-N
InChI
InChI=1S/C5H5BrN2/c1-4-2-3-7-5(6)8-4/h2-3H,1H3

Weigh it out

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

Work with 2-Bromo-4-methylpyrimidine

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

2,4-Dibromopyrimidine3921-01-554 % similar 2-Chloro-4-methylpyrimidine13036-57-252 % similar 4-Methyl-2-(methylthio)pyrimidine14001-63-948 % similar 4-Methyl-2-pyrimidinol monohydrochloride5348-51-645 % similar 2-Mercapto-4-methylpyrimidine hydrochloride6959-66-645 % similar 2-Bromo-4-(trifluoro methyl)pryrimidine785777-87-945 % similar 4-Bromo-2-methylpyridine22282-99-145 % similar 2,4-Lutidine108-47-443 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-5-bromopyridine1072-97-5 6-Bromopyridin-3-amine13534-97-9 4-Amino-3-bromopyridine13534-98-0 2-Amino-3-bromopyridine13534-99-1 3-Amino-5-bromopyridine13535-01-8 2-Bromo-5-methylpyrimidine150010-20-1 2-Amino-6-bromopyridine19798-81-3 3-Amino-4-bromopyridine239137-39-4

Elsewhere

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