SMILES:
N#Cc1cc2c(cc1O)CCC2Molecular Processing
Molecular formula
C10H9NO
Molecular weight
159.19
Exact mass
159.0684
XLogP
1.75
TPSA
44.02
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
44.85
Supplementary Information
Details werden geladen…
An 3 Reaktionen beteiligt→