이름: (3aRS,7SR,7aRS)-7-methyl-7-phenyl-4-perhydroisoindolone hydrochloride
SMILES:
CC1(c2ccccc2)CCC(=O)C2CNCC21.ClMolecular Processing
Molecular formula
C15H20ClNO
Molecular weight
265.78
Exact mass
265.1233
XLogP
2.56
TPSA
29.1
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
3
Covalent units
2
Fraction Csp3
0.533
Molar refractivity
75.13
Supplementary Information
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