CCOC(=O)C(C)(CCCCBr)c1ccc(C)cc1
SMILES: CCOC(=O)C(C)(CCCCBr)c1ccc(C)cc1

Molecular Processing

Molecular formula
C16H23BrO2
Molecular weight
327.26
Exact mass
326.0881
XLogP
4.38
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
7
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
82.81

Supplementary Information

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Involved in 5 reactions→

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