Name: ethyl 2-(6-(2-(dimethylamino)ethoxy)-1-hydroxy-4-methyl-1,3-dihydrobenzo[c][1,2]oxaborol-3-yl)acetate
SMILES:
CCOC(=O)CC1OB(O)c2cc(OCCN(C)C)cc(C)c21Molecular Processing
Molecular formula
C16H24BNO5
Molecular weight
321.18
Exact mass
321.1748
XLogP
0.65
TPSA
68.23
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
23
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.562
Molar refractivity
87.91
Supplementary Information
Details werden geladen…
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