이름: ethyl 2[(2-chlorophenyl)amino]-4-oxo-4,5-dihydrofuran-3-carboxylate
SMILES:
CCOC(=O)C1=C(Nc2ccccc2Cl)OCC1=OMolecular Processing
Molecular formula
C13H12ClNO4
Molecular weight
281.7
Exact mass
281.0455
XLogP
2.13
TPSA
64.63
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.231
Molar refractivity
69.69
Supplementary Information
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