Name: 1-bromo-2-chlorobutane
SMILES:
CCC(Cl)CBrMolecular Processing
Molecular formula
C4H8BrCl
Molecular weight
171.46
Exact mass
169.9498
XLogP
2.4
TPSA
0
H-bond donors
0
H-bond acceptors
0
Rotatable bonds
2
Heavy atoms
6
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
1
Molar refractivity
33.73
Supplementary Information
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