COc1ccc(C(=O)C(Br)c2ccc(OC)cc2)cc1
名称: p-Methoxy-2-bromo-2-(p-methoxyphenyl)acetophenone
SMILES: COc1ccc(C(=O)C(Br)c2ccc(OC)cc2)cc1

Molecular Processing

Molecular formula
C16H15BrO3
Molecular weight
335.2
Exact mass
334.0205
XLogP
4.02
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
81.99

Supplementary Information

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