이름: 3',4'-dichlorophenyl-3,4-dimethyl-2-hydroxy-5-oxo-2,5-dihydropyrrole
SMILES:
CC1=C(C)C(O)N(c2ccc(Cl)c(Cl)c2)C1=OMolecular Processing
Molecular formula
C12H11Cl2NO2
Molecular weight
272.13
Exact mass
271.0167
XLogP
2.99
TPSA
40.54
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
68.33
Supplementary Information
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