O=[N+]([O-])c1ccc(C2CCc3cncn32)cc1Cl
名称: 5-(3-chloro-4-nitrophenyl)-6,7-dihydro-5H-pyrrolo[1,2-c]imidazole
SMILES: O=[N+]([O-])c1ccc(C2CCc3cncn32)cc1Cl

Molecular Processing

Molecular formula
C12H10ClN3O2
Molecular weight
263.68
Exact mass
263.0462
XLogP
2.98
TPSA
60.96
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
66.79

Supplementary Information

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