Nombre: N-(2-ethylhexyl)urea
SMILES:
CCCCC(CC)CNC(N)=OMolecular Processing
Molecular formula
C9H20N2O
Molecular weight
172.27
Exact mass
172.1576
XLogP
1.87
TPSA
55.12
H-bond donors
2
H-bond acceptors
1
Rotatable bonds
6
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.889
Molar refractivity
50.89
Supplementary Information
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