1,2,2-trifluoroethylcyclopropane

C5H7F3 — CID 18520930

IUPAC1,2,2-trifluoroethylcyclopropane
SMILESFC(F)C(F)C1CC1
InChIInChI=1S/C5H7F3/c6-4(5(7)8)3-1-2-3/h3-5H,1-2H2
InChIKeyXOHBQQMRQDOVAK-UHFFFAOYSA-N
MW124.10 g/mol
LogP2.00
Rot. Bonds2

About 1,2,2-trifluoroethylcyclopropane

1,2,2-trifluoroethylcyclopropane (PubChem CID 18520930) has the molecular formula C5H7F3 and a molecular weight of 124.10 g/mol. Its IUPAC name is 1,2,2-trifluoroethylcyclopropane.

Molecular Properties

Compound Name1,2,2-trifluoroethylcyclopropane
PubChem CID18520930
Molecular FormulaC5H7F3
Molecular Weight124.10 g/mol
Exact Mass124.05
IUPAC Name1,2,2-trifluoroethylcyclopropane
SMILESFC(F)C(F)C1CC1
InChIInChI=1S/C5H7F3/c6-4(5(7)8)3-1-2-3/h3-5H,1-2H2
InChIKeyXOHBQQMRQDOVAK-UHFFFAOYSA-N
XLogP2.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.10
LogP ≤ 52.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,2,2-trifluoroethylcyclopropane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,2,2-trifluoroethylcyclopropane?
The IUPAC name of 1,2,2-trifluoroethylcyclopropane (CID 18520930) is 1,2,2-trifluoroethylcyclopropane.
What is the SMILES notation for 1,2,2-trifluoroethylcyclopropane?
The canonical SMILES for 1,2,2-trifluoroethylcyclopropane is FC(F)C(F)C1CC1.
What is the InChIKey of 1,2,2-trifluoroethylcyclopropane?
The InChIKey is XOHBQQMRQDOVAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H7F3/c6-4(5(7)8)3-1-2-3/h3-5H,1-2H2.
What are the key properties of 1,2,2-trifluoroethylcyclopropane?
1,2,2-trifluoroethylcyclopropane has a molecular weight of 124.10 g/mol, XLogP of 2.00, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2-trifluoroethylcyclopropane is sourced from PubChem (CID 18520930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).