이름: 4-chloro-1-ethynyl-2-fluorobenzene
SMILES:
C#Cc1ccc(Cl)cc1FMolecular Processing
Molecular formula
C8H4ClF
Molecular weight
154.57
Exact mass
153.9986
XLogP
2.46
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
10
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
39.35
Supplementary Information
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