SMILES:
CCOC(=O)C(CBr)=NOMolecular Processing
Molecular formula
C5H8BrNO3
Molecular weight
210.03
Exact mass
208.9688
XLogP
0.77
TPSA
58.89
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
10
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.6
Molar refractivity
39.65
Supplementary Information
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