Name: 4-methyl-5-oxiran-2-yl-2-benzofuran-1(3H)-one
SMILES:
Cc1c(C2CO2)ccc2c1COC2=OMolecular Processing
Molecular formula
C11H10O3
Molecular weight
190.2
Exact mass
190.063
XLogP
1.74
TPSA
38.83
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
14
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
48.99
Supplementary Information
Details werden geladen…
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