2-Bromo-5-methylpyrimidine

C5H5BrN2CAS 150010-20-1173.01 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

Warning
Irritant (GHS07)

Aggregated from the 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+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
150010-20-1
SMILES
CC1=CN=C(N=C1)Br
InChIKey
KYCGEJNZMHUBMX-UHFFFAOYSA-N
InChI
InChI=1S/C5H5BrN2/c1-4-2-7-5(6)8-3-4/h2-3H,1H3

Weigh it out

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

Work with 2-Bromo-5-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

2,5-Dibromopyrimidine32779-37-652 % similar 2-Chloro-5-methylpyrimidine22536-61-450 % similar 2-Bromo-5-methoxypyrimidine1209459-99-348 % similar 2-Bromo-5-methylpyridine3510-66-548 % similar 2-Bromopyrimidin-5-ol1240621-87-748 % similar 2-Bromo-5-chloropyrimidine124405-67-048 % similar 2-Bromo-5-fluoropyrimidine947533-45-148 % similar 2,3-Dibromo-5-methylpyridine29232-39-144 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

2-Amino-5-bromopyridine1072-97-5 2-Bromo-4-methylpyrimidine130645-48-6 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-Amino-6-bromopyridine19798-81-3 3-Amino-4-bromopyridine239137-39-4

Elsewhere

PubChem CAS Common Chemistry NIST WebBook