1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene

C7H7F7 — CID 23264394

IUPAC1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene
SMILESCC(C)C(F)(F)C(=C(F)F)C(F)(F)F
InChIInChI=1S/C7H7F7/c1-3(2)6(10,11)4(5(8)9)7(12,13)14/h3H,1-2H3
InChIKeyFDLJKTQPFLACHM-UHFFFAOYSA-N
MW224.12 g/mol
LogP3.99
Rot. Bonds2

About 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene

1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene (PubChem CID 23264394) has the molecular formula C7H7F7 and a molecular weight of 224.12 g/mol. Its IUPAC name is 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene.

Molecular Properties

Compound Name1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene
PubChem CID23264394
Molecular FormulaC7H7F7
Molecular Weight224.12 g/mol
Exact Mass224.04
IUPAC Name1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene
SMILESCC(C)C(F)(F)C(=C(F)F)C(F)(F)F
InChIInChI=1S/C7H7F7/c1-3(2)6(10,11)4(5(8)9)7(12,13)14/h3H,1-2H3
InChIKeyFDLJKTQPFLACHM-UHFFFAOYSA-N
XLogP3.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.12
LogP ≤ 53.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene?
The IUPAC name of 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene (CID 23264394) is 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene.
What is the SMILES notation for 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene?
The canonical SMILES for 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene is CC(C)C(F)(F)C(=C(F)F)C(F)(F)F.
What is the InChIKey of 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene?
The InChIKey is FDLJKTQPFLACHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F7/c1-3(2)6(10,11)4(5(8)9)7(12,13)14/h3H,1-2H3.
What are the key properties of 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene?
1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene has a molecular weight of 224.12 g/mol, XLogP of 3.99, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3-tetrafluoro-4-methyl-2-(trifluoromethyl)pent-1-ene is sourced from PubChem (CID 23264394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).