Название: 1-(ethoxymethyl)-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrazole
SMILES:
CCOCn1nccc1B1OC(C)(C)C(C)(C)O1Molecular Processing
Molecular formula
C12H21BN2O3
Molecular weight
252.12
Exact mass
252.1645
XLogP
1.18
TPSA
45.51
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
69.57
Supplementary Information
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