الاسم: 7-ethenyl-2-methyl-3,4-dihydro-1(2H)-isoquinolinone
SMILES:
C=Cc1ccc2c(c1)C(=O)N(C)CC2Molecular Processing
Molecular formula
C12H13NO
Molecular weight
187.24
Exact mass
187.0997
XLogP
1.96
TPSA
20.31
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
14
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
0.25
Molar refractivity
57.2
Supplementary Information
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