名称: 6A
SMILES:
BrCc1cccc2cc3c(cc12)oc1ccccc13Molecular Processing
Molecular formula
C17H11BrO
Molecular weight
311.18
Exact mass
309.9993
XLogP
5.63
TPSA
13.14
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
19
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.059
Molar refractivity
83.86
Supplementary Information
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