3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane

C7H12F2 — CID 121273882

IUPAC3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane
SMILESCCC1C(C)(C)C1(F)F
InChIInChI=1S/C7H12F2/c1-4-5-6(2,3)7(5,8)9/h5H,4H2,1-3H3
InChIKeyGHFUSPJSEFJJNQ-UHFFFAOYSA-N
MW134.17 g/mol
LogP2.69
Rot. Bonds1

About 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane

3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane (PubChem CID 121273882) has the molecular formula C7H12F2 and a molecular weight of 134.17 g/mol. Its IUPAC name is 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane.

Molecular Properties

Compound Name3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane
PubChem CID121273882
Molecular FormulaC7H12F2
Molecular Weight134.17 g/mol
Exact Mass134.09
IUPAC Name3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane
SMILESCCC1C(C)(C)C1(F)F
InChIInChI=1S/C7H12F2/c1-4-5-6(2,3)7(5,8)9/h5H,4H2,1-3H3
InChIKeyGHFUSPJSEFJJNQ-UHFFFAOYSA-N
XLogP2.69
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.17
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane 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 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane?
The IUPAC name of 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane (CID 121273882) is 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane.
What is the SMILES notation for 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane?
The canonical SMILES for 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane is CCC1C(C)(C)C1(F)F.
What is the InChIKey of 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane?
The InChIKey is GHFUSPJSEFJJNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F2/c1-4-5-6(2,3)7(5,8)9/h5H,4H2,1-3H3.
What are the key properties of 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane?
3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane has a molecular weight of 134.17 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1,1-difluoro-2,2-dimethylcyclopropane is sourced from PubChem (CID 121273882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).