1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane

C5H4F10 — CID 22481284

IUPAC1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane
SMILESFCC(F)(F)C(F)(F)F.FCC(F)(F)F
InChIInChI=1S/C3H2F6.C2H2F4/c4-1-2(5,6)3(7,8)9;3-1-2(4,5)6/h1H2;1H2
InChIKeyAYYBQQTZMPTQFX-UHFFFAOYSA-N
MW254.07 g/mol
LogP3.67
Rot. Bonds1

About 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane

1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane (PubChem CID 22481284) has the molecular formula C5H4F10 and a molecular weight of 254.07 g/mol. Its IUPAC name is 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane.

Molecular Properties

Compound Name1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane
PubChem CID22481284
Molecular FormulaC5H4F10
Molecular Weight254.07 g/mol
Exact Mass254.02
IUPAC Name1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane
SMILESFCC(F)(F)C(F)(F)F.FCC(F)(F)F
InChIInChI=1S/C3H2F6.C2H2F4/c4-1-2(5,6)3(7,8)9;3-1-2(4,5)6/h1H2;1H2
InChIKeyAYYBQQTZMPTQFX-UHFFFAOYSA-N
XLogP3.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.07
LogP ≤ 53.67
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-hexafluoropropane;hydrate
CID 23202835
ethane;1,1,1,2,2,3-hexafluoropropane
CID 143490804
benzene;1,1,1,2,2,3-hexafluoropropane
CID 174871596
1,1,1,2,2-pentafluorobutane;1,1,1,2-tetrafluoroethane
CID 161114745
1,1,1,2-tetrafluoroethane;hydrate
CID 87179187
1-chloro-1,2,2-trifluoroethane;1,1,1,2,2,3-hexafluoropropane
CID 88674301
1,1,1,2,2,3-hexafluoropropane;trimethoxysilane
CID 175523544
fluoromethane;1,1,1,2,2,3-hexafluoropropane;methane;1,1,1,2,3-pentafluoropropan-2-yl hypofluorite
CID 159599668
methoxymethane;1,1,1,2,2-pentafluoropropane;1,1,1,2-tetrafluoroethane
CID 158386104
oxirane;1,1,1,2-tetrafluoroethane
CID 121447840
1,1,1,2,2,5,5,5-octafluoropentane
CID 22457046
2-benzofuran-1,3-dione;1,1,1,2,2,3-hexafluoropropane
CID 88602325

Frequently Asked Questions

What is the IUPAC name of 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane?
The IUPAC name of 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane (CID 22481284) is 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane.
What is the SMILES notation for 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane?
The canonical SMILES for 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane is FCC(F)(F)C(F)(F)F.FCC(F)(F)F.
What is the InChIKey of 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane?
The InChIKey is AYYBQQTZMPTQFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H2F6.C2H2F4/c4-1-2(5,6)3(7,8)9;3-1-2(4,5)6/h1H2;1H2.
What are the key properties of 1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane?
1,1,1,2,2,3-hexafluoropropane;1,1,1,2-tetrafluoroethane has a molecular weight of 254.07 g/mol, XLogP of 3.67, 1 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-hexafluoropropane;1,1,1,2-tetrafluoroethane is sourced from PubChem (CID 22481284), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).