Methyl 5,5,6,6,7,7,8,8,8-nonafluoro-2-(3,3,3-trifluoropropylsulfonyl)octanoate

HCID 57788426
NotesReactions
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Basic information

Standard SMILES
COC(=O)C(CCC(F)(F)C(F)(F)C(F)(F)C(F)(F)F)S(=O)(=O)CCC(F)(F)F
InChIKey
PUGXMJADFVEZSF-UHFFFAOYSA-N
Molecular formula
C12H12F12O4S
Average molar mass
480.27 g/mol

Names & identifiers

Preferred name
Methyl 5,5,6,6,7,7,8,8,8-nonafluoro-2-(3,3,3-trifluoropropylsulfonyl)octanoate
IUPAC
methyl 5,5,6,6,7,7,8,8,8-nonafluoro-2-(3,3,3-trifluoropropylsulfonyl)octanoate

Names & synonyms

SCHEMBL2429757PUGXMJADFVEZSF-UHFFFAOYSA-Nmethyl 5,5,6,6,7,7,8,8,8-nonafluoro-2-(3,3,3-trifluoropropylsulfonyl)octanoate

Database identifiers

PubChem CID
57788426

Properties

Computed structural properties

XLogP
4.9
Topological polar surface area
68.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
16
Rotatable bonds
10
Heavy atoms
29

Related reactions

2 records
New reaction record

Compound notes

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