O=C(Cl)CCCCBr
SMILES: O=C(Cl)CCCCBr

Molecular Processing

Molecular formula
C5H8BrClO
Molecular weight
199.48
Exact mass
197.9447
XLogP
2.32
TPSA
17.07
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
8
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.8
Molar refractivity
38.51

Supplementary Information

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