(E)-1,1,1,3-tetrafluorobut-2-ene

C4H4F4 — CID 44717370

IUPAC(E)-1,1,1,3-tetrafluorobut-2-ene
SMILESC/C(F)=C\C(F)(F)F
InChIInChI=1S/C4H4F4/c1-3(5)2-4(6,7)8/h2H,1H3/b3-2+
InChIKeyVSPVOSOCAZPIJQ-NSCUHMNNSA-N
MW128.07 g/mol
LogP2.42
Rot. Bonds

About (E)-1,1,1,3-tetrafluorobut-2-ene

(E)-1,1,1,3-tetrafluorobut-2-ene (PubChem CID 44717370) has the molecular formula C4H4F4 and a molecular weight of 128.07 g/mol. Its IUPAC name is (E)-1,1,1,3-tetrafluorobut-2-ene.

Molecular Properties

Compound Name(E)-1,1,1,3-tetrafluorobut-2-ene
PubChem CID44717370
Molecular FormulaC4H4F4
Molecular Weight128.07 g/mol
Exact Mass128.02
IUPAC Name(E)-1,1,1,3-tetrafluorobut-2-ene
SMILESC/C(F)=C\C(F)(F)F
InChIInChI=1S/C4H4F4/c1-3(5)2-4(6,7)8/h2H,1H3/b3-2+
InChIKeyVSPVOSOCAZPIJQ-NSCUHMNNSA-N
XLogP2.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.07
LogP ≤ 52.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (E)-1,1,1,3-tetrafluorobut-2-ene?
The IUPAC name of (E)-1,1,1,3-tetrafluorobut-2-ene (CID 44717370) is (E)-1,1,1,3-tetrafluorobut-2-ene.
What is the SMILES notation for (E)-1,1,1,3-tetrafluorobut-2-ene?
The canonical SMILES for (E)-1,1,1,3-tetrafluorobut-2-ene is C/C(F)=C\C(F)(F)F.
What is the InChIKey of (E)-1,1,1,3-tetrafluorobut-2-ene?
The InChIKey is VSPVOSOCAZPIJQ-NSCUHMNNSA-N. The full InChI is InChI=1S/C4H4F4/c1-3(5)2-4(6,7)8/h2H,1H3/b3-2+.
What are the key properties of (E)-1,1,1,3-tetrafluorobut-2-ene?
(E)-1,1,1,3-tetrafluorobut-2-ene has a molecular weight of 128.07 g/mol, XLogP of 2.42, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1,1,1,3-tetrafluorobut-2-ene is sourced from PubChem (CID 44717370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).