C=CCOc1ccc(CCl)cc1C
Name: 1-allyloxy-4-chloromethyl-2-methyl-benzene
SMILES: C=CCOc1ccc(CCl)cc1C

Molecular Processing

Molecular formula
C11H13ClO
Molecular weight
196.68
Exact mass
196.0655
XLogP
3.3
TPSA
9.23
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
4
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
56.43

Supplementary Information

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