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

C7H12F2 — CID 18684620

IUPAC1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane
SMILESCCC1(C)C(C)C1(F)F
InChIInChI=1S/C7H12F2/c1-4-6(3)5(2)7(6,8)9/h5H,4H2,1-3H3
InChIKeyMWYQAGYAXUMAJM-UHFFFAOYSA-N
MW134.17 g/mol
LogP2.69
Rot. Bonds1

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

1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane (PubChem CID 18684620) has the molecular formula C7H12F2 and a molecular weight of 134.17 g/mol. Its IUPAC name is 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane.

Molecular Properties

Compound Name1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane
PubChem CID18684620
Molecular FormulaC7H12F2
Molecular Weight134.17 g/mol
Exact Mass134.09
IUPAC Name1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane
SMILESCCC1(C)C(C)C1(F)F
InChIInChI=1S/C7H12F2/c1-4-6(3)5(2)7(6,8)9/h5H,4H2,1-3H3
InChIKeyMWYQAGYAXUMAJM-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

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane?
The IUPAC name of 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane (CID 18684620) is 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane.
What is the SMILES notation for 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane?
The canonical SMILES for 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane is CCC1(C)C(C)C1(F)F.
What is the InChIKey of 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane?
The InChIKey is MWYQAGYAXUMAJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12F2/c1-4-6(3)5(2)7(6,8)9/h5H,4H2,1-3H3.
What are the key properties of 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane?
1-ethyl-2,2-difluoro-1,3-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 1-ethyl-2,2-difluoro-1,3-dimethylcyclopropane is sourced from PubChem (CID 18684620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).