Name: methyl 4-{[2-(chloromethyl)-2-propenyl]oxy}-3-[(phenylsulfonyl)methyl]benzoate
SMILES:
C=C(CCl)COc1ccc(C(=O)OC)cc1CS(=O)(=O)c1ccccc1Molecular Processing
Molecular formula
C19H19ClO5S
Molecular weight
394.88
Exact mass
394.0642
XLogP
3.62
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
26
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.211
Molar refractivity
100.47
Supplementary Information
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