2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane

C9F16O — CID 13451003

IUPAC2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane
SMILESFC1(F)OC(F)(C2(F)C(F)(F)C(F)(F)C(F)(F)C2(F)F)C(F)(F)C1(F)F
InChIInChI=1S/C9F16O/c10-1(2(11,12)4(15,16)5(17,18)3(1,13)14)8(23)6(19,20)7(21,22)9(24,25)26-8
InChIKeyRWRLSZYZAAPJSJ-UHFFFAOYSA-N
MW428.07 g/mol
LogP4.81
Rot. Bonds1

About 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane

2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane (PubChem CID 13451003) has the molecular formula C9F16O and a molecular weight of 428.07 g/mol. Its IUPAC name is 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane.

Molecular Properties

Compound Name2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane
PubChem CID13451003
Molecular FormulaC9F16O
Molecular Weight428.07 g/mol
Exact Mass427.97
IUPAC Name2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane
SMILESFC1(F)OC(F)(C2(F)C(F)(F)C(F)(F)C(F)(F)C2(F)F)C(F)(F)C1(F)F
InChIInChI=1S/C9F16O/c10-1(2(11,12)4(15,16)5(17,18)3(1,13)14)8(23)6(19,20)7(21,22)9(24,25)26-8
InChIKeyRWRLSZYZAAPJSJ-UHFFFAOYSA-N
XLogP4.81
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.07
LogP ≤ 54.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Perfluoro(1-oxaspiro[4.4]nonane)
CID 567768
2,2,3,3,4,4,5-Heptafluoro-5-(1,1,1,2,3,3,4,4,4-nonafluorobutan-2-yl)oxolane
CID 13271514
2,2,3,4,4,5-Hexafluoro-3-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-5-(1,1,2,2,2-pentafluoroethyl)oxolane
CID 20388267
2,2,3,4,4,5-Hexafluoro-3,5-bis(1,1,2,2,3,3,3-heptafluoropropyl)oxolane
CID 85610321
2,2,3,3,4,4-Hexafluoro-5,5-bis(1,1,2,2,3,3,4,4,4-nonafluorobutyl)oxolane
CID 88776726
1,1,2,2,3,3,4,5-Octafluoro-4-(1,1,2,2,3,3,3-heptafluoropropyl)-5-[1,2,2,3,3,4,4,5-octafluoro-5-(1,1,2,2,3,3,3-heptafluoropropyl)cyclopentyl]oxycyclopentane
CID 141480343
1,1,2,2,3,3,4,5-Octafluoro-4-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-5-[1,2,2,3,3,4,4,5-octafluoro-5-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)cyclopentyl]oxycyclopentane
CID 141480344
2,3,3,4,4,5-Hexafluoro-2,5-bis(1,1,1,2,3,3,3-heptafluoropropan-2-yl)oxolane
CID 167433158
2,2,3,3,4,5-Hexafluoro-5-(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,9-nonadecafluorononyl)-4-(1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexyl)oxolane
CID 172728698
2,2,3,3,4,4,5-Heptafluoro-5-(1,2,2,3,3,4,4-heptafluorocyclobutyl)oxolane
CID 13271516
2,2,3,3,4,4,5-Heptafluoro-5-(1,2,2,3,3,4,4,5,5,6,6-undecafluorocyclohexyl)oxolane
CID 13451005
2,2,3,3,4,4-Hexafluoro-5-(1,1,2,2,3,3,4,4,4-nonafluorobutyl)-5-(trifluoromethyl)oxolane
CID 102600924

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane?
The IUPAC name of 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane (CID 13451003) is 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane.
What is the SMILES notation for 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane?
The canonical SMILES for 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane is FC1(F)OC(F)(C2(F)C(F)(F)C(F)(F)C(F)(F)C2(F)F)C(F)(F)C1(F)F.
What is the InChIKey of 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane?
The InChIKey is RWRLSZYZAAPJSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9F16O/c10-1(2(11,12)4(15,16)5(17,18)3(1,13)14)8(23)6(19,20)7(21,22)9(24,25)26-8.
What are the key properties of 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane?
2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane has a molecular weight of 428.07 g/mol, XLogP of 4.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3,4,4,5-heptafluoro-5-(1,2,2,3,3,4,4,5,5-nonafluorocyclopentyl)oxolane is sourced from PubChem (CID 13451003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).