1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene

C5F6 — CID 580208

IUPAC1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene
SMILESFC1=C(F)C(F)(F)C(F)=C1F
InChIInChI=1S/C5F6/c6-1-2(7)4(9)5(10,11)3(1)8
InChIKeyBDTKCOREDQRWGK-UHFFFAOYSA-N
MW174.04 g/mol
LogP2.94
Rot. Bonds

About 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene

1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene (PubChem CID 580208) has the molecular formula C5F6 and a molecular weight of 174.04 g/mol. Its IUPAC name is 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene.

Molecular Properties

Compound Name1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene
PubChem CID580208
Molecular FormulaC5F6
Molecular Weight174.04 g/mol
Exact Mass173.99
IUPAC Name1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene
SMILESFC1=C(F)C(F)(F)C(F)=C1F
InChIInChI=1S/C5F6/c6-1-2(7)4(9)5(10,11)3(1)8
InChIKeyBDTKCOREDQRWGK-UHFFFAOYSA-N
XLogP2.94
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.04
LogP ≤ 52.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene?
The IUPAC name of 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene (CID 580208) is 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene.
What is the SMILES notation for 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene?
The canonical SMILES for 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene is FC1=C(F)C(F)(F)C(F)=C1F.
What is the InChIKey of 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene?
The InChIKey is BDTKCOREDQRWGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5F6/c6-1-2(7)4(9)5(10,11)3(1)8.
What are the key properties of 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene?
1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene has a molecular weight of 174.04 g/mol, XLogP of 2.94, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,5-hexafluorocyclopenta-1,3-diene is sourced from PubChem (CID 580208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).