SMILES:
CC1(C)OB(c2cc(I)cc3cc[nH]c23)OC1(C)CMolecular Processing
Molecular formula
C14H17BINO2
Molecular weight
369.01
Exact mass
369.0397
XLogP
3.07
TPSA
34.25
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
86.73
Supplementary Information
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