Name: product
SMILES:
Cc1cc2c(N=C=O)cccc2cn1Molecular Processing
Molecular formula
C11H8N2O
Molecular weight
184.2
Exact mass
184.0637
XLogP
2.51
TPSA
42.32
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
54.26
Supplementary Information
Details werden geladen…
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