Name: 6,7-dichloro-1-methyl-1,2,3,4-tetrahydro-isoquinoline
SMILES:
CC1NCCc2cc(Cl)c(Cl)cc21Molecular Processing
Molecular formula
C10H11Cl2N
Molecular weight
216.11
Exact mass
215.0269
XLogP
3.2
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
56.58
Supplementary Information
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