CC(=O)OC(CCCCC(F)(F)F)CCCCl
Name: (1-chloro-9,9,9-trifluorononan-4-yl) acetate
SMILES: CC(=O)OC(CCCCC(F)(F)F)CCCCl

Molecular Processing

Molecular formula
C11H18ClF3O2
Molecular weight
274.71
Exact mass
274.0947
XLogP
4.06
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
8
Heavy atoms
17
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.909
Molar refractivity
60.03

Supplementary Information

InChIKey: BIZJXKPQMYKGSW-UHFFFAOYSA-N
Synonyms
1-Chloro-4-acetoxy-9,9,9-trifluorononaneSCHEMBL115156391-chloro-4-acetoxy-9,9,9trifluorononane
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Involved in 10 reactions→

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