SMILES:
CC(C)(C)C1CCC(OC(=O)C(=O)Cl)CC1Molecular Processing
Molecular formula
C12H19ClO3
Molecular weight
246.73
Exact mass
246.1023
XLogP
2.9
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
62.15
Supplementary Information
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