1-ethenyl-2,3,3-trifluorocyclobutene

C6H5F3 — CID 640496

IUPAC1-ethenyl-2,3,3-trifluorocyclobutene
SMILESC=CC1=C(F)C(F)(F)C1
InChIInChI=1S/C6H5F3/c1-2-4-3-6(8,9)5(4)7/h2H,1,3H2
InChIKeyZGGMSGVUAHZKPG-UHFFFAOYSA-N
MW134.10 g/mol
LogP2.43
Rot. Bonds1

About 1-ethenyl-2,3,3-trifluorocyclobutene

1-ethenyl-2,3,3-trifluorocyclobutene (PubChem CID 640496) has the molecular formula C6H5F3 and a molecular weight of 134.10 g/mol. Its IUPAC name is 1-ethenyl-2,3,3-trifluorocyclobutene.

Molecular Properties

Compound Name1-ethenyl-2,3,3-trifluorocyclobutene
PubChem CID640496
Molecular FormulaC6H5F3
Molecular Weight134.10 g/mol
Exact Mass134.03
IUPAC Name1-ethenyl-2,3,3-trifluorocyclobutene
SMILESC=CC1=C(F)C(F)(F)C1
InChIInChI=1S/C6H5F3/c1-2-4-3-6(8,9)5(4)7/h2H,1,3H2
InChIKeyZGGMSGVUAHZKPG-UHFFFAOYSA-N
XLogP2.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.10
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-2,3,3-trifluorocyclobutene?
The IUPAC name of 1-ethenyl-2,3,3-trifluorocyclobutene (CID 640496) is 1-ethenyl-2,3,3-trifluorocyclobutene.
What is the SMILES notation for 1-ethenyl-2,3,3-trifluorocyclobutene?
The canonical SMILES for 1-ethenyl-2,3,3-trifluorocyclobutene is C=CC1=C(F)C(F)(F)C1.
What is the InChIKey of 1-ethenyl-2,3,3-trifluorocyclobutene?
The InChIKey is ZGGMSGVUAHZKPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F3/c1-2-4-3-6(8,9)5(4)7/h2H,1,3H2.
What are the key properties of 1-ethenyl-2,3,3-trifluorocyclobutene?
1-ethenyl-2,3,3-trifluorocyclobutene has a molecular weight of 134.10 g/mol, XLogP of 2.43, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-2,3,3-trifluorocyclobutene is sourced from PubChem (CID 640496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).