Decanoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester

HCID 540907

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Basic information

CAS: 18798-10-2
Standard SMILES: CCCCCCCCCC(=O)OCC(F)(F)C(F)(F)C(F)(F)C(F)F
InChIKey: UAYJPUNXOMATLD-UHFFFAOYSA-N
Molecular formula: C15H22F8O2
Average molar mass: 386.32 g/mol
Monoisotopic mass: 386.14920524

Names & identifiers

Preferred name: Decanoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester
IUPAC: 2,2,3,3,4,4,5,5-octafluoropentyl decanoate
English name: Decanoic acid 2,2,3,3,4,4,5,5-octafluoropentyl ester
Molecular formula: C15H22F8O2
Molecular weight: 386.32

Names & synonyms

Decanoic acid, 2,2,3,3,4,4,5,5-octafluoropentyl ester18798-10-2DTXSID20337264RefChem:336740DTXCID102883522,2,3,3,4,4,5,5-Octafluoropentyl decanoateDecanoic acid 2,2,3,3,4,4,5,5-octafluoropentyl ester1,1,5-Trihydroperfluoropentyl decanoateUAYJPUNXOMATLD-UHFFFAOYSA-N2,2,3,3,4,4,5,5-Octafluoropentyl decanoate #

Database identifiers

CAS: 18798-10-2
PubChem CID: 540907
DTXSID: DTXSID20337264
Nikkaji: J145.205C

Properties

Computed structural properties

XLogP: 7.1
Topological polar surface area: 26.3 Å²
Hydrogen bond donors: 0
Hydrogen bond acceptors: 10
Rotatable bonds: 14
Heavy atoms: 25
Formal charge: 0
Complexity: 399

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