Name: ethyl 5-(3,4-dichlorobenzyl)-1,2,4-oxadiazole-3-carboxylate
SMILES:
CCOC(=O)c1noc(Cc2ccc(Cl)c(Cl)c2)n1Molecular Processing
Molecular formula
C12H10Cl2N2O3
Molecular weight
301.13
Exact mass
300.0068
XLogP
3.14
TPSA
65.22
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
69.52
Supplementary Information
Details werden geladen…
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