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Perfluoropropane

C3F8 — CID 6432

💊View drug profile → perflutren

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC1,1,1,2,2,3,3,3-octafluoropropane
SMILESFC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C3F8/c4-1(5,2(6,7)8)3(9,10)11
InChIKeyQYSGYZVSCZSLHT-UHFFFAOYSA-N
MW188.02 g/mol
LogP2.75
Rot. Bonds

About Perfluoropropane

Perfluoropropane (PubChem CID 6432) has the molecular formula C3F8 and a molecular weight of 188.02 g/mol. Its IUPAC name is 1,1,1,2,2,3,3,3-octafluoropropane.

Molecular Properties

Compound NamePerfluoropropane
PubChem CID6432
Molecular FormulaC3F8
Molecular Weight188.02 g/mol
Exact Mass187.99
IUPAC Name1,1,1,2,2,3,3,3-octafluoropropane
SMILESFC(F)(F)C(F)(F)C(F)(F)F
InChIInChI=1S/C3F8/c4-1(5,2(6,7)8)3(9,10)11
InChIKeyQYSGYZVSCZSLHT-UHFFFAOYSA-N
XLogP2.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.02
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

1,1,1,2,2,3,3,4,4,4-decafluorobutane;hydrofluoride
CID 175814235
CID 175811708
CID 175811708
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-hexadecafluoroheptane;1,1,1,2,2,3,3,4,4,5,5,6,6,6-tetradecafluorohexane
CID 22712913
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,12,12,13,13,14,14,15,15,16,16,17,17,18,18,19,19,20,20,21,21,21-tetratetracontafluorohenicosane
CID 141072652
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-octadecafluorooctane;hydrochloride
CID 172708323
1,1,2,2,3,3,3-heptafluoropropylstibane
CID 173388121
ethane;1,1,1,2,2,3,3-heptafluorobutane
CID 170760942
CID 22349056
CID 22349056
1,2,2,3,3,3-hexafluoropropane-1,1-diamine;hydrate
CID 172729995
1,1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,9,9-nonadecafluorodecane
CID 22600357
1,1,2,2,3,3,4,4,5,5,6,6,7,7,7-pentadecafluoroheptane-1-thiol
CID 141473432
1,1,2,2,3,3,4,4,5,5,6,6,6-tridecafluorohexylphosphane
CID 21095712

Frequently Asked Questions

What is the IUPAC name of Perfluoropropane?
The IUPAC name of Perfluoropropane (CID 6432) is 1,1,1,2,2,3,3,3-octafluoropropane.
What is the SMILES notation for Perfluoropropane?
The canonical SMILES for Perfluoropropane is FC(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of Perfluoropropane?
The InChIKey is QYSGYZVSCZSLHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3F8/c4-1(5,2(6,7)8)3(9,10)11.
What are the key properties of Perfluoropropane?
Perfluoropropane has a molecular weight of 188.02 g/mol, XLogP of 2.75, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for Perfluoropropane is sourced from PubChem (CID 6432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

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