이름: 4-chloromethyl-2-(4-cyanophenyl) oxazole
SMILES:
N#Cc1ccc(-c2nc(CCl)co2)cc1Molecular Processing
Molecular formula
C11H7ClN2O
Molecular weight
218.64
Exact mass
218.0247
XLogP
2.95
TPSA
49.82
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
56.21
Supplementary Information
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