fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane

C8H18F6 — CID 91005996

IUPACfluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane
SMILESCCC.CCF.CF.FCC(F)(F)F
InChIInChI=1S/C3H8.C2H2F4.C2H5F.CH3F/c1-3-2;3-1-2(4,5)6;1-2-3;1-2/h3H2,1-2H3;1H2;2H2,1H3;1H3
InChIKeyKAAVIYQFXDQXDQ-UHFFFAOYSA-N
MW228.22 g/mol
LogP4.50
Rot. Bonds

About fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane

fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane (PubChem CID 91005996) has the molecular formula C8H18F6 and a molecular weight of 228.22 g/mol. Its IUPAC name is fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane.

Molecular Properties

Compound Namefluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane
PubChem CID91005996
Molecular FormulaC8H18F6
Molecular Weight228.22 g/mol
Exact Mass228.13
IUPAC Namefluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane
SMILESCCC.CCF.CF.FCC(F)(F)F
InChIInChI=1S/C3H8.C2H2F4.C2H5F.CH3F/c1-3-2;3-1-2(4,5)6;1-2-3;1-2/h3H2,1-2H3;1H2;2H2,1H3;1H3
InChIKeyKAAVIYQFXDQXDQ-UHFFFAOYSA-N
XLogP4.50
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.22
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane?
The IUPAC name of fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane (CID 91005996) is fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane.
What is the SMILES notation for fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane?
The canonical SMILES for fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane is CCC.CCF.CF.FCC(F)(F)F.
What is the InChIKey of fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane?
The InChIKey is KAAVIYQFXDQXDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8.C2H2F4.C2H5F.CH3F/c1-3-2;3-1-2(4,5)6;1-2-3;1-2/h3H2,1-2H3;1H2;2H2,1H3;1H3.
What are the key properties of fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane?
fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane has a molecular weight of 228.22 g/mol, XLogP of 4.50, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for fluoroethane;fluoromethane;propane;1,1,1,2-tetrafluoroethane is sourced from PubChem (CID 91005996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).