Name: 2-Chloromethyl-3-methyl-benzofuran
SMILES:
Cc1c(CCl)oc2ccccc12Molecular Processing
Molecular formula
C10H9ClO
Molecular weight
180.63
Exact mass
180.0342
XLogP
3.48
TPSA
13.14
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
12
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
50.51
Supplementary Information
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