CCOC(=O)C(=O)c1ccc(C2CCCCC2)c(Cl)c1
Name: ethyl 3-chloro-4-cyclohexylphenylglyoxylate
SMILES: CCOC(=O)C(=O)c1ccc(C2CCCCC2)c(Cl)c1

Molecular Processing

Molecular formula
C16H19ClO3
Molecular weight
294.78
Exact mass
294.1023
XLogP
4.13
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
78.24

Supplementary Information

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