3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane

C7H7F7O — CID 71345323

IUPAC3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane
SMILESFC(F)(F)C(F)(F)C(F)(F)C1CCOC1
InChIInChI=1S/C7H7F7O/c8-5(9,4-1-2-15-3-4)6(10,11)7(12,13)14/h4H,1-3H2
InChIKeyUYLGTFQVYFWRFU-UHFFFAOYSA-N
MW240.12 g/mol
LogP2.86
Rot. Bonds2

About 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane

3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane (PubChem CID 71345323) has the molecular formula C7H7F7O and a molecular weight of 240.12 g/mol. Its IUPAC name is 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane.

Molecular Properties

Compound Name3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane
PubChem CID71345323
Molecular FormulaC7H7F7O
Molecular Weight240.12 g/mol
Exact Mass240.04
IUPAC Name3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane
SMILESFC(F)(F)C(F)(F)C(F)(F)C1CCOC1
InChIInChI=1S/C7H7F7O/c8-5(9,4-1-2-15-3-4)6(10,11)7(12,13)14/h4H,1-3H2
InChIKeyUYLGTFQVYFWRFU-UHFFFAOYSA-N
XLogP2.86
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.12
LogP ≤ 52.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-Fluoro-2-(1,1,2,2,2-pentafluoroethyl)-3,3-bis(trifluoromethyl)oxolane
CID 12730902
5-Ethyl-2,2,3,3,5-pentafluoro-4-(fluoromethyl)oxolane
CID 20725476
2,3,4-Tris(trifluoromethyl)oxolane
CID 21411182
2-(1,1,1,3,3,3-Hexafluoropropan-2-yl)oxolane
CID 21810349
3-(1,1,2,2,3,3,4,4,4-Nonafluorobutyl)oxolane
CID 53693161
2-(1,1-Difluoroethyl)-2,3,3,4-tetrafluoro-4-methyloxolane
CID 58473338
4,5-Bis(1,1-difluoroethyl)-2,2,3,3,5-pentafluorooxolane
CID 58731910
2-(1,2-Difluoroethyl)-2,3,4,4,5,5-hexafluoro-3-(fluoromethyl)oxolane
CID 58813259
1-(1,1-Difluoropropoxy)-4,4-difluoro-3-(trifluoromethyl)hexane
CID 59172657
4,5-Bis(1,1-difluoroethyl)-2,2,3,3,4-pentafluorooxolane
CID 59288803
2,3-Bis(1,1-difluoroethyl)oxolane
CID 68025133
2-(1,1-Difluoroethyl)-2,3,4,5-tetrafluoro-3-(fluoromethyl)oxolane
CID 89125653

Frequently Asked Questions

What is the IUPAC name of 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane?
The IUPAC name of 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane (CID 71345323) is 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane.
What is the SMILES notation for 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane?
The canonical SMILES for 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane is FC(F)(F)C(F)(F)C(F)(F)C1CCOC1.
What is the InChIKey of 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane?
The InChIKey is UYLGTFQVYFWRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F7O/c8-5(9,4-1-2-15-3-4)6(10,11)7(12,13)14/h4H,1-3H2.
What are the key properties of 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane?
3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane has a molecular weight of 240.12 g/mol, XLogP of 2.86, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1,1,2,2,3,3,3-heptafluoropropyl)oxolane is sourced from PubChem (CID 71345323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).