SMILES:
O=[N+]([O-])c1ccc(OCCCCl)cc1Molecular Processing
Molecular formula
C9H10ClNO3
Molecular weight
215.64
Exact mass
215.0349
XLogP
2.6
TPSA
52.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
53.93
Supplementary Information
Details werden geladen…
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