CCCCC(CC)C(=O)OC1=C(c2ccccc2Cl)C(=O)CC(C)(C)C1
SMILES: CCCCC(CC)C(=O)OC1=C(c2ccccc2Cl)C(=O)CC(C)(C)C1

Molecular Processing

Molecular formula
C22H29ClO3
Molecular weight
376.92
Exact mass
376.1805
XLogP
6.2
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
7
Heavy atoms
26
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.545
Molar refractivity
105.79

Supplementary Information

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