名称: [2'-(5-trichloromethyl-1,2,4-oxadiazol-3-yl)biphenyl-4-yl]methyl bromide
SMILES:
ClC(Cl)(Cl)c1nc(-c2ccccc2-c2ccc(CBr)cc2)no1Molecular Processing
Molecular formula
C16H10BrCl3N2O
Molecular weight
432.53
Exact mass
429.9042
XLogP
6.13
TPSA
38.92
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
97.04
Supplementary Information
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