1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene

C11F18 — CID 11762501

IUPAC1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene
SMILESFC(F)(F)C1=C(C(F)(F)F)C(C(F)(F)F)(C(F)(F)F)C(C(F)(F)F)=C1C(F)(F)F
InChIInChI=1S/C11F18/c12-6(13,14)1-2(7(15,16)17)4(9(21,22)23)5(10(24,25)26,11(27,28)29)3(1)8(18,19)20
InChIKeyFORVOHAOZHHYML-UHFFFAOYSA-N
MW474.09 g/mol
LogP6.95
Rot. Bonds

About 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene

1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene (PubChem CID 11762501) has the molecular formula C11F18 and a molecular weight of 474.09 g/mol. Its IUPAC name is 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene.

Molecular Properties

Compound Name1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene
PubChem CID11762501
Molecular FormulaC11F18
Molecular Weight474.09 g/mol
Exact Mass473.97
IUPAC Name1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene
SMILESFC(F)(F)C1=C(C(F)(F)F)C(C(F)(F)F)(C(F)(F)F)C(C(F)(F)F)=C1C(F)(F)F
InChIInChI=1S/C11F18/c12-6(13,14)1-2(7(15,16)17)4(9(21,22)23)5(10(24,25)26,11(27,28)29)3(1)8(18,19)20
InChIKeyFORVOHAOZHHYML-UHFFFAOYSA-N
XLogP6.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.09
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Perfluoro-3,4-dimethyl-4-ethylhex-2-ene
CID 527537
2-Hexene, 4-ethyl, 3,4-dimethyl, perfluoro-
CID 5352546
(4E)-1-fluoro-4-[1,1,1,3,4,4,4-heptafluoro-3-(trifluoromethyl)butan-2-ylidene]-2,3,3-tris(trifluoromethyl)cyclobutene
CID 12710296
(4Z)-1-fluoro-4-[1,1,1,3,4,4,4-heptafluoro-3-(trifluoromethyl)butan-2-ylidene]-2,3,3-tris(trifluoromethyl)cyclobutene
CID 21732860
1,1,1,3,5,5,6,6,6-Nonafluoro-4-(1,1,2,2,2-pentafluoroethyl)-2,4-bis(trifluoromethyl)hex-2-ene
CID 19047903
5-Fluoro-1,2,3,4,5-pentakis(trifluoromethyl)cyclopenta-1,3-diene
CID 140036070
3-(Difluoromethylidene)-1-fluoro-2-[1,1,1,3,3,4,4,4-octafluoro-2-(trifluoromethyl)butan-2-yl]cyclopropene
CID 140118119
3-(Difluoromethylidene)-1-fluoro-2-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]cyclopropene
CID 140118129
5-(1,1,2,2,2-Pentafluoroethyl)-1,2,3,4,5-pentakis(trifluoromethyl)cyclopenta-1,3-diene
CID 162536243

Frequently Asked Questions

What is the IUPAC name of 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene?
The IUPAC name of 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene (CID 11762501) is 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene.
What is the SMILES notation for 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene?
The canonical SMILES for 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene is FC(F)(F)C1=C(C(F)(F)F)C(C(F)(F)F)(C(F)(F)F)C(C(F)(F)F)=C1C(F)(F)F.
What is the InChIKey of 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene?
The InChIKey is FORVOHAOZHHYML-UHFFFAOYSA-N. The full InChI is InChI=1S/C11F18/c12-6(13,14)1-2(7(15,16)17)4(9(21,22)23)5(10(24,25)26,11(27,28)29)3(1)8(18,19)20.
What are the key properties of 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene?
1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene has a molecular weight of 474.09 g/mol, XLogP of 6.95, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,3,4,5,5-hexakis(trifluoromethyl)cyclopenta-1,3-diene is sourced from PubChem (CID 11762501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).