الاسم: di-tert-butyl (6′-bromo-2′,2′-dimethyldispiro[1,3-oxazole-4,4′-chromene-3′,3″-oxetan]-2-yl)imidodicarbonate
SMILES:
CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)C1=NC2(CO1)c1cc(Br)ccc1OC(C)(C)C21COC1Molecular Processing
Molecular formula
C25H33BrN2O7
Molecular weight
553.45
Exact mass
552.1471
XLogP
5.39
TPSA
95.89
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
0
Heavy atoms
35
Rings
4
Aromatic rings
1
Saturated rings
1
Aliphatic rings
3
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.64
Molar refractivity
131.47
Supplementary Information
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