2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane

C8H10F6 — CID 121274072

IUPAC2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane
SMILESCC1CC1(C(C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H10F6/c1-4-3-6(4,8(12,13)14)5(2)7(9,10)11/h4-5H,3H2,1-2H3
InChIKeyWHHKOCICGVORFT-UHFFFAOYSA-N
MW220.16 g/mol
LogP3.77
Rot. Bonds1

About 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane

2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane (PubChem CID 121274072) has the molecular formula C8H10F6 and a molecular weight of 220.16 g/mol. Its IUPAC name is 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane.

Molecular Properties

Compound Name2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane
PubChem CID121274072
Molecular FormulaC8H10F6
Molecular Weight220.16 g/mol
Exact Mass220.07
IUPAC Name2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane
SMILESCC1CC1(C(C)C(F)(F)F)C(F)(F)F
InChIInChI=1S/C8H10F6/c1-4-3-6(4,8(12,13)14)5(2)7(9,10)11/h4-5H,3H2,1-2H3
InChIKeyWHHKOCICGVORFT-UHFFFAOYSA-N
XLogP3.77
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.16
LogP ≤ 53.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane 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 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane?
The IUPAC name of 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane (CID 121274072) is 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane.
What is the SMILES notation for 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane?
The canonical SMILES for 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane is CC1CC1(C(C)C(F)(F)F)C(F)(F)F.
What is the InChIKey of 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane?
The InChIKey is WHHKOCICGVORFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F6/c1-4-3-6(4,8(12,13)14)5(2)7(9,10)11/h4-5H,3H2,1-2H3.
What are the key properties of 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane?
2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane has a molecular weight of 220.16 g/mol, XLogP of 3.77, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(trifluoromethyl)-1-(1,1,1-trifluoropropan-2-yl)cyclopropane is sourced from PubChem (CID 121274072), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).