الاسم: di-tert-butyl 2,2′-(3-(5-(benzyloxy)-2-bromophenyl)-4,5-dihydro-1,2-oxazole-5,5-diyl)diacetate
SMILES:
CC(C)(C)OC(=O)CC1(CC(=O)OC(C)(C)C)CC(c2cc(OCc3ccccc3)ccc2Br)=NO1Molecular Processing
Molecular formula
C28H34BrNO6
Molecular weight
560.49
Exact mass
559.1569
XLogP
6.35
TPSA
83.42
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
36
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.464
Molar refractivity
140.81
Supplementary Information
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