SMILES:
NCCC#Cc1ccccc1Molecular Processing
Molecular formula
C10H11N
Molecular weight
145.2
Exact mass
145.0891
XLogP
1.39
TPSA
26.02
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
1
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
46.99
Supplementary Information
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