Name: 1-bromo-4-(2-methoxyethenyl)benzene
SMILES:
COC=Cc1ccc(Br)cc1Molecular Processing
Molecular formula
C9H9BrO
Molecular weight
213.07
Exact mass
211.9837
XLogP
3.07
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
50.19
Supplementary Information
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