이름: 1-iodo-2-pentyne
SMILES:
CCC#CCIMolecular Processing
Molecular formula
C5H7I
Molecular weight
194.01
Exact mass
193.9592
XLogP
1.83
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
0
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
36.95
Supplementary Information
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