Name: allyl-[2-(4-amino-phenyl)ethyl]-carbamic acid tert-butyl ester
SMILES:
C=CCN(CCc1ccc(N)cc1)C(=O)OC(C)(C)CMolecular Processing
Molecular formula
C16H24N2O2
Molecular weight
276.38
Exact mass
276.1838
XLogP
3.23
TPSA
55.56
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
20
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
0.438
Molar refractivity
82.56
Supplementary Information
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