C=C(Br)CCC(=O)NC(C(=O)OCC)C(=O)OCC
Name: product
SMILES: C=C(Br)CCC(=O)NC(C(=O)OCC)C(=O)OCC

Molecular Processing

Molecular formula
C12H18BrNO5
Molecular weight
336.18
Exact mass
335.0368
XLogP
1.29
TPSA
81.7
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
19
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
72.5

Supplementary Information

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