1-ethyl-2-(trifluoromethyl)cyclobutane

C7H11F3 — CID 149336016

IUPAC1-ethyl-2-(trifluoromethyl)cyclobutane
SMILESCCC1CCC1C(F)(F)F
InChIInChI=1S/C7H11F3/c1-2-5-3-4-6(5)7(8,9)10/h5-6H,2-4H2,1H3
InChIKeyYDGFPEYDNWSWLM-UHFFFAOYSA-N
MW152.16 g/mol
LogP2.98
Rot. Bonds1

About 1-ethyl-2-(trifluoromethyl)cyclobutane

1-ethyl-2-(trifluoromethyl)cyclobutane (PubChem CID 149336016) has the molecular formula C7H11F3 and a molecular weight of 152.16 g/mol. Its IUPAC name is 1-ethyl-2-(trifluoromethyl)cyclobutane.

Molecular Properties

Compound Name1-ethyl-2-(trifluoromethyl)cyclobutane
PubChem CID149336016
Molecular FormulaC7H11F3
Molecular Weight152.16 g/mol
Exact Mass152.08
IUPAC Name1-ethyl-2-(trifluoromethyl)cyclobutane
SMILESCCC1CCC1C(F)(F)F
InChIInChI=1S/C7H11F3/c1-2-5-3-4-6(5)7(8,9)10/h5-6H,2-4H2,1H3
InChIKeyYDGFPEYDNWSWLM-UHFFFAOYSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.16
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-(trifluoromethyl)cyclobutane?
The IUPAC name of 1-ethyl-2-(trifluoromethyl)cyclobutane (CID 149336016) is 1-ethyl-2-(trifluoromethyl)cyclobutane.
What is the SMILES notation for 1-ethyl-2-(trifluoromethyl)cyclobutane?
The canonical SMILES for 1-ethyl-2-(trifluoromethyl)cyclobutane is CCC1CCC1C(F)(F)F.
What is the InChIKey of 1-ethyl-2-(trifluoromethyl)cyclobutane?
The InChIKey is YDGFPEYDNWSWLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11F3/c1-2-5-3-4-6(5)7(8,9)10/h5-6H,2-4H2,1H3.
What are the key properties of 1-ethyl-2-(trifluoromethyl)cyclobutane?
1-ethyl-2-(trifluoromethyl)cyclobutane has a molecular weight of 152.16 g/mol, XLogP of 2.98, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-(trifluoromethyl)cyclobutane is sourced from PubChem (CID 149336016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).