Name: 3-nitro-2-(4-chlorophenyl)thiophene
SMILES:
O=[N+]([O-])c1ccsc1-c1ccc(Cl)cc1Molecular Processing
Molecular formula
C10H6ClNO2S
Molecular weight
239.68
Exact mass
238.9808
XLogP
3.98
TPSA
43.14
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
61.42
Supplementary Information
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