1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane

C6H7F5 — CID 121274020

IUPAC1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane
SMILESCCC1(C(F)(F)F)CC1(F)F
InChIInChI=1S/C6H7F5/c1-2-4(6(9,10)11)3-5(4,7)8/h2-3H2,1H3
InChIKeyWXCWSSMMGYGPNG-UHFFFAOYSA-N
MW174.11 g/mol
LogP2.98
Rot. Bonds1

About 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane

1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane (PubChem CID 121274020) has the molecular formula C6H7F5 and a molecular weight of 174.11 g/mol. Its IUPAC name is 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane.

Molecular Properties

Compound Name1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane
PubChem CID121274020
Molecular FormulaC6H7F5
Molecular Weight174.11 g/mol
Exact Mass174.05
IUPAC Name1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane
SMILESCCC1(C(F)(F)F)CC1(F)F
InChIInChI=1S/C6H7F5/c1-2-4(6(9,10)11)3-5(4,7)8/h2-3H2,1H3
InChIKeyWXCWSSMMGYGPNG-UHFFFAOYSA-N
XLogP2.98
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.11
LogP ≤ 52.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

1,1,2-triethyl-2-(trifluoromethyl)cyclopropane
CID 121274019
[2,2-difluoro-1-(trifluoromethyl)cyclopropyl]methanol
CID 58388254
1,1-diethyl-2,2-bis(trifluoromethyl)cyclopropane
CID 121274265
1-ethyl-2,2-difluoro-1-propan-2-ylcyclopropane
CID 89275697
2-ethyl-2-(trifluoromethyl)oxirane
CID 23233498
1-ethyl-2,2-difluoro-3,3-dimethyl-1-(trifluoromethyl)cyclopropane
CID 121274032
1-butan-2-yl-3,3-difluoro-1-(trifluoromethyl)cyclobutane
CID 146382834
2-ethyl-4,5-difluoro-2-methyl-4,5-bis(trifluoromethyl)-1,3-dioxolane
CID 170016088
1-ethyl-3,3-difluorocyclobutan-1-amine
CID 115011285
2-ethyl-4-[2-ethyl-4,5,5-trifluoro-2-(trifluoromethyl)-1,3-dioxolan-4-yl]-4,5,5-trifluoro-2-(trifluoromethyl)-1,3-dioxolane
CID 59628174
1-ethyl-1-methyl-2-(2,2,2-trifluoroethyl)cyclopropane
CID 121274275
1,1-difluoro-2-(2-methylpropyl)-2-propylcyclopropane
CID 170411670

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane?
The IUPAC name of 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane (CID 121274020) is 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane.
What is the SMILES notation for 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane?
The canonical SMILES for 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane is CCC1(C(F)(F)F)CC1(F)F.
What is the InChIKey of 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane?
The InChIKey is WXCWSSMMGYGPNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F5/c1-2-4(6(9,10)11)3-5(4,7)8/h2-3H2,1H3.
What are the key properties of 1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane?
1-ethyl-2,2-difluoro-1-(trifluoromethyl)cyclopropane has a molecular weight of 174.11 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-2,2-difluoro-1-(trifluoromethyl)cyclopropane is sourced from PubChem (CID 121274020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).