(Z)-1,1,2,4,4-pentafluorobut-2-ene

C4H3F5 — CID 21096855

IUPAC(Z)-1,1,2,4,4-pentafluorobut-2-ene
SMILESF/C(=C\C(F)F)C(F)F
InChIInChI=1S/C4H3F5/c5-2(4(8)9)1-3(6)7/h1,3-4H/b2-1-
InChIKeyDDKFHEFCVPCJKU-UPHRSURJSA-N
MW146.06 g/mol
LogP2.37
Rot. Bonds2

About (Z)-1,1,2,4,4-pentafluorobut-2-ene

(Z)-1,1,2,4,4-pentafluorobut-2-ene (PubChem CID 21096855) has the molecular formula C4H3F5 and a molecular weight of 146.06 g/mol. Its IUPAC name is (Z)-1,1,2,4,4-pentafluorobut-2-ene.

Molecular Properties

Compound Name(Z)-1,1,2,4,4-pentafluorobut-2-ene
PubChem CID21096855
Molecular FormulaC4H3F5
Molecular Weight146.06 g/mol
Exact Mass146.02
IUPAC Name(Z)-1,1,2,4,4-pentafluorobut-2-ene
SMILESF/C(=C\C(F)F)C(F)F
InChIInChI=1S/C4H3F5/c5-2(4(8)9)1-3(6)7/h1,3-4H/b2-1-
InChIKeyDDKFHEFCVPCJKU-UPHRSURJSA-N
XLogP2.37
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.06
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (Z)-1,1,2,4,4-pentafluorobut-2-ene?
The IUPAC name of (Z)-1,1,2,4,4-pentafluorobut-2-ene (CID 21096855) is (Z)-1,1,2,4,4-pentafluorobut-2-ene.
What is the SMILES notation for (Z)-1,1,2,4,4-pentafluorobut-2-ene?
The canonical SMILES for (Z)-1,1,2,4,4-pentafluorobut-2-ene is F/C(=C\C(F)F)C(F)F.
What is the InChIKey of (Z)-1,1,2,4,4-pentafluorobut-2-ene?
The InChIKey is DDKFHEFCVPCJKU-UPHRSURJSA-N. The full InChI is InChI=1S/C4H3F5/c5-2(4(8)9)1-3(6)7/h1,3-4H/b2-1-.
What are the key properties of (Z)-1,1,2,4,4-pentafluorobut-2-ene?
(Z)-1,1,2,4,4-pentafluorobut-2-ene has a molecular weight of 146.06 g/mol, XLogP of 2.37, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1,1,2,4,4-pentafluorobut-2-ene is sourced from PubChem (CID 21096855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).