1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane

C10H12F10O — CID 11859046

IUPAC1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane
SMILESFC(F)(F)C(F)(F)CCCOCCCC(F)(F)C(F)(F)F
InChIInChI=1S/C10H12F10O/c11-7(12,9(15,16)17)3-1-5-21-6-2-4-8(13,14)10(18,19)20/h1-6H2
InChIKeyOTSCEYMRHHIIIC-UHFFFAOYSA-N
MW338.19 g/mol
LogP4.96
Rot. Bonds8

About 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane

1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane (PubChem CID 11859046) has the molecular formula C10H12F10O and a molecular weight of 338.19 g/mol. Its IUPAC name is 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane.

Molecular Properties

Compound Name1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane
PubChem CID11859046
Molecular FormulaC10H12F10O
Molecular Weight338.19 g/mol
Exact Mass338.07
IUPAC Name1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane
SMILESFC(F)(F)C(F)(F)CCCOCCCC(F)(F)C(F)(F)F
InChIInChI=1S/C10H12F10O/c11-7(12,9(15,16)17)3-1-5-21-6-2-4-8(13,14)10(18,19)20/h1-6H2
InChIKeyOTSCEYMRHHIIIC-UHFFFAOYSA-N
XLogP4.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.19
LogP ≤ 54.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Related Compounds

1,1,2,2,3,3,4,4-Octafluoro-5-(1,1,2,2-tetrafluoroethoxy)pentane
CID 2782579
1,1,1,2,2,3,3-Heptafluoro-4-(2,2,3,3,4,4,4-heptafluorobutoxy)butane
CID 22646028
1-Ethoxy-1,1,2,2,3,3,4,4,5,5,5-undecafluoropentane
CID 23432499
1,1,1,2,2,3,3,4,4-Nonafluoro-6-propoxyhexane
CID 44480565
1,1,1,2,2,3,3,4,4-Nonafluoro-6-(pentyloxy)hexane
CID 44480566
6-(1,1-Difluoroethoxy)-1,1,1,2,2,3,3,4,4,5,5-undecafluorohexane
CID 85753373
(Perfluorohexyl)ethyl ether
CID 87277022
2,2,3,3,4,4,5,5-Octafluoropentyl difluoromethylether
CID 10333943
Decafluoro-di-n-pentylether
CID 11688646
Pentane, 1,1'-oxybis[2,2,3,3,4,4,5,5-octafluoro-
CID 12100158
Bis(1-(perfluorobutyl)ethyl) ether
CID 21954135
6-Ethoxy-1,1,1,2,2,3,3,4,4-nonafluorohexane
CID 54330931

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane?
The IUPAC name of 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane (CID 11859046) is 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane.
What is the SMILES notation for 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane?
The canonical SMILES for 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane is FC(F)(F)C(F)(F)CCCOCCCC(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane?
The InChIKey is OTSCEYMRHHIIIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F10O/c11-7(12,9(15,16)17)3-1-5-21-6-2-4-8(13,14)10(18,19)20/h1-6H2.
What are the key properties of 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane?
1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane has a molecular weight of 338.19 g/mol, XLogP of 4.96, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,1,2,2-pentafluoro-5-(4,4,5,5,5-pentafluoropentoxy)pentane is sourced from PubChem (CID 11859046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).