이름: 2-chloro-4-ethynyl-pyridine
SMILES:
C#Cc1ccnc(Cl)c1Molecular Processing
Molecular formula
C7H4ClN
Molecular weight
137.57
Exact mass
137.0032
XLogP
1.72
TPSA
12.89
H-bond donors
0
H-bond acceptors
1
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
2
Covalent units
1
Fraction Csp3
0
Molar refractivity
37.18
Supplementary Information
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