이름: 5-bromo-3,3-dimethyl-2,3-dihydro-1H-indole
SMILES:
CC1(C)CNc2ccc(Br)cc21Molecular Processing
Molecular formula
C10H12BrN
Molecular weight
226.12
Exact mass
225.0153
XLogP
3.15
TPSA
12.03
H-bond donors
1
H-bond acceptors
1
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
0.4
Molar refractivity
55.66
Supplementary Information
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