1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene

C4H2F6 — CID 11480623

IUPAC1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene
SMILESFCC(=C(F)F)C(F)(F)F
InChIInChI=1S/C4H2F6/c5-1-2(3(6)7)4(8,9)10/h1H2
InChIKeyZOGUJMXLOXUYAP-UHFFFAOYSA-N
MW164.05 g/mol
LogP2.67
Rot. Bonds1

About 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene

1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene (PubChem CID 11480623) has the molecular formula C4H2F6 and a molecular weight of 164.05 g/mol. Its IUPAC name is 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene.

Molecular Properties

Compound Name1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene
PubChem CID11480623
Molecular FormulaC4H2F6
Molecular Weight164.05 g/mol
Exact Mass164.01
IUPAC Name1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene
SMILESFCC(=C(F)F)C(F)(F)F
InChIInChI=1S/C4H2F6/c5-1-2(3(6)7)4(8,9)10/h1H2
InChIKeyZOGUJMXLOXUYAP-UHFFFAOYSA-N
XLogP2.67
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.05
LogP ≤ 52.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene?
The IUPAC name of 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene (CID 11480623) is 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene.
What is the SMILES notation for 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene?
The canonical SMILES for 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene is FCC(=C(F)F)C(F)(F)F.
What is the InChIKey of 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene?
The InChIKey is ZOGUJMXLOXUYAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H2F6/c5-1-2(3(6)7)4(8,9)10/h1H2.
What are the key properties of 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene?
1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene has a molecular weight of 164.05 g/mol, XLogP of 2.67, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3,3-pentafluoro-2-(fluoromethyl)prop-1-ene is sourced from PubChem (CID 11480623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).