Cc1nc(Cl)ncc1Br
Name: 5-bromo-2-chloro-4-methylpyrimidine
SMILES: Cc1nc(Cl)ncc1Br

Molecular Processing

Molecular formula
C5H4BrClN2
Molecular weight
207.46
Exact mass
205.9246
XLogP
2.2
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
39.48

Supplementary Information

Details werden geladen…

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