이름: 2-Benzyl-4-bromo-phenol
SMILES:
Oc1ccc(Br)cc1Cc1ccccc1Molecular Processing
Molecular formula
C13H11BrO
Molecular weight
263.13
Exact mass
261.9993
XLogP
3.75
TPSA
20.23
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.077
Molar refractivity
65.05
Supplementary Information
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