Name: [2-(4-iodophenyl)-1,1-dimethyl-ethyl]-carbamic acid tert-butyl ester
SMILES:
CC(C)(Cc1ccc(I)cc1)NC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C15H22INO2
Molecular weight
375.25
Exact mass
375.0695
XLogP
4.14
TPSA
38.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
86.31
Supplementary Information
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