1,1,1,2,2,3,3,3-octafluoropropane

C3F8 — CID 6432

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 1,1,1,2,2,3,3,3-octafluoropropane

1,1,1,2,2,3,3,3-octafluoropropane (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 Name1,1,1,2,2,3,3,3-octafluoropropane
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
tris(1,1,2,2,3,3,4,4,4-nonafluorobutyl)arsane
CID 15800040

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,2,3,3,3-octafluoropropane?
The IUPAC name of 1,1,1,2,2,3,3,3-octafluoropropane (CID 6432) is 1,1,1,2,2,3,3,3-octafluoropropane.
What is the SMILES notation for 1,1,1,2,2,3,3,3-octafluoropropane?
The canonical SMILES for 1,1,1,2,2,3,3,3-octafluoropropane is FC(F)(F)C(F)(F)C(F)(F)F.
What is the InChIKey of 1,1,1,2,2,3,3,3-octafluoropropane?
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 1,1,1,2,2,3,3,3-octafluoropropane?
1,1,1,2,2,3,3,3-octafluoropropane 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 1,1,1,2,2,3,3,3-octafluoropropane is sourced from PubChem (CID 6432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).