الاسم: ethyl 2-methyl-4-oxo-2-cyclohexenecarboxylate
SMILES:
CCOC(=O)C1CCC(=O)C=C1CMolecular Processing
Molecular formula
C10H14O3
Molecular weight
182.22
Exact mass
182.0943
XLogP
1.47
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
0
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
48.12
Supplementary Information
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