CCOC(=O)C(Br)(Oc1cccc2[nH]ccc12)C(=O)OCC
SMILES: CCOC(=O)C(Br)(Oc1cccc2[nH]ccc12)C(=O)OCC

Molecular Processing

Molecular formula
C15H16BrNO5
Molecular weight
370.2
Exact mass
369.0212
XLogP
2.76
TPSA
77.62
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
83.85

Supplementary Information

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