Name: 2-(4-Chlorophenyl)-2-methyloxirane
SMILES:
CC1(c2ccc(Cl)cc2)CO1Molecular Processing
Molecular formula
C9H9ClO
Molecular weight
168.62
Exact mass
168.0342
XLogP
2.59
TPSA
12.53
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
11
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
44.76
Supplementary Information
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