1,2,3,3,4,4-hexafluorocyclobutene;hydron

C4HF6+ — CID 19083376

IUPAC1,2,3,3,4,4-hexafluorocyclobutene;hydron
SMILESFC1=C(F)C(F)(F)C1(F)F.[H+]
InChIInChI=1S/C4F6/c5-1-2(6)4(9,10)3(1,7)8/p+1
InChIKeyQVHWOZCZUNPZPW-UHFFFAOYSA-O
MW163.04 g/mol
LogP2.53
Rot. Bonds

About 1,2,3,3,4,4-hexafluorocyclobutene;hydron

1,2,3,3,4,4-hexafluorocyclobutene;hydron (PubChem CID 19083376) has the molecular formula C4HF6+ and a molecular weight of 163.04 g/mol. Its IUPAC name is 1,2,3,3,4,4-hexafluorocyclobutene;hydron.

Molecular Properties

Compound Name1,2,3,3,4,4-hexafluorocyclobutene;hydron
PubChem CID19083376
Molecular FormulaC4HF6+
Molecular Weight163.04 g/mol
Exact Mass163.00
IUPAC Name1,2,3,3,4,4-hexafluorocyclobutene;hydron
SMILESFC1=C(F)C(F)(F)C1(F)F.[H+]
InChIInChI=1S/C4F6/c5-1-2(6)4(9,10)3(1,7)8/p+1
InChIKeyQVHWOZCZUNPZPW-UHFFFAOYSA-O
XLogP2.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500163.04
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,2,3,3,4,4-hexafluorocyclobutene;hydron?
The IUPAC name of 1,2,3,3,4,4-hexafluorocyclobutene;hydron (CID 19083376) is 1,2,3,3,4,4-hexafluorocyclobutene;hydron.
What is the SMILES notation for 1,2,3,3,4,4-hexafluorocyclobutene;hydron?
The canonical SMILES for 1,2,3,3,4,4-hexafluorocyclobutene;hydron is FC1=C(F)C(F)(F)C1(F)F.[H+].
What is the InChIKey of 1,2,3,3,4,4-hexafluorocyclobutene;hydron?
The InChIKey is QVHWOZCZUNPZPW-UHFFFAOYSA-O. The full InChI is InChI=1S/C4F6/c5-1-2(6)4(9,10)3(1,7)8/p+1.
What are the key properties of 1,2,3,3,4,4-hexafluorocyclobutene;hydron?
1,2,3,3,4,4-hexafluorocyclobutene;hydron has a molecular weight of 163.04 g/mol, XLogP of 2.53, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,3,4,4-hexafluorocyclobutene;hydron is sourced from PubChem (CID 19083376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).