COC1=CC(=CC(=C1OS(=O)(=O)C(F)(F)F)CC=C)Cl
الاسم: (4-chloro-2-methoxy-6-prop-2-enylphenyl) trifluoromethanesulfonate
SMILES: COC1=CC(=CC(=C1OS(=O)(=O)C(F)(F)F)CC=C)Cl

Molecular Processing

Molecular formula
C11H10ClF3O4S
Molecular weight
330.71
Exact mass
329.994
XLogP
3.31
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
20
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
67.51

Supplementary Information

InChIKey: RTYQXUZSZYMEBQ-UHFFFAOYSA-N
مرادفات
2-allyl-4-chloro-6-methoxyphenyl trifluoromethanesulfonateSCHEMBL3292307
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