[3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane

C7H8F6 — CID 87736977

IUPAC[3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane
SMILESFC(F)(F)C(CC1CC1)C(F)(F)F
InChIInChI=1S/C7H8F6/c8-6(9,10)5(7(11,12)13)3-4-1-2-4/h4-5H,1-3H2
InChIKeyUJXOREHSULLDHJ-UHFFFAOYSA-N
MW206.13 g/mol
LogP3.53
Rot. Bonds2

About [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane

[3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane (PubChem CID 87736977) has the molecular formula C7H8F6 and a molecular weight of 206.13 g/mol. Its IUPAC name is [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane.

Molecular Properties

Compound Name[3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane
PubChem CID87736977
Molecular FormulaC7H8F6
Molecular Weight206.13 g/mol
Exact Mass206.05
IUPAC Name[3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane
SMILESFC(F)(F)C(CC1CC1)C(F)(F)F
InChIInChI=1S/C7H8F6/c8-6(9,10)5(7(11,12)13)3-4-1-2-4/h4-5H,1-3H2
InChIKeyUJXOREHSULLDHJ-UHFFFAOYSA-N
XLogP3.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.13
LogP ≤ 53.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane?
The IUPAC name of [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane (CID 87736977) is [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane.
What is the SMILES notation for [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane?
The canonical SMILES for [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane is FC(F)(F)C(CC1CC1)C(F)(F)F.
What is the InChIKey of [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane?
The InChIKey is UJXOREHSULLDHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F6/c8-6(9,10)5(7(11,12)13)3-4-1-2-4/h4-5H,1-3H2.
What are the key properties of [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane?
[3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane has a molecular weight of 206.13 g/mol, XLogP of 3.53, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [3,3,3-trifluoro-2-(trifluoromethyl)propyl]cyclopropane is sourced from PubChem (CID 87736977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).