Name: 2-(5-bromo-2-methoxyphenyl)-4,4-dimethyl-4,5-dihydrooxazole
SMILES:
COc1ccc(Br)cc1C1=NC(C)(C)CO1Molecular Processing
Molecular formula
C12H14BrNO2
Molecular weight
284.15
Exact mass
283.0208
XLogP
3.01
TPSA
30.82
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
67.26
Supplementary Information
Details werden geladen…
An 6 Reaktionen beteiligt→