이름: 5-pentyl-2-bromopyrimidine
SMILES:
CCCCCc1cnc(Br)nc1Molecular Processing
Molecular formula
C9H13BrN2
Molecular weight
229.12
Exact mass
228.0262
XLogP
2.97
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.556
Molar refractivity
52.96
Supplementary Information
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