이름: 4-chloro-6-(1-fluoro-ethyl)-5-iodopyrimidine
SMILES:
CC(F)c1ncnc(Cl)c1IMolecular Processing
Molecular formula
C6H5ClFIN2
Molecular weight
286.48
Exact mass
285.917
XLogP
2.77
TPSA
25.78
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
49.28
Supplementary Information
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