Name: ether
SMILES:
CC(C)(C)NCC(O)COc1cccc2ccccc12Molecular Processing
Molecular formula
C17H23NO2
Molecular weight
273.38
Exact mass
273.1729
XLogP
2.97
TPSA
41.49
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
83.21
Supplementary Information
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