CSC1(Cl)CCCCC1=O
SMILES: CSC1(Cl)CCCCC1=O

Molecular Processing

Molecular formula
C7H11ClOS
Molecular weight
178.68
Exact mass
178.0219
XLogP
2.43
TPSA
17.07
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
10
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.857
Molar refractivity
45.57

Supplementary Information

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