5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol

C7H5F7O — CID 89202826

IUPAC5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol
SMILESOC1(C(F)(F)F)C=CCC1(F)C(F)(F)F
InChIInChI=1S/C7H5F7O/c8-4(6(9,10)11)2-1-3-5(4,15)7(12,13)14/h1,3,15H,2H2
InChIKeyRHRMPUVEAJBWRI-UHFFFAOYSA-N
MW238.10 g/mol
LogP2.51
Rot. Bonds

About 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol

5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol (PubChem CID 89202826) has the molecular formula C7H5F7O and a molecular weight of 238.10 g/mol. Its IUPAC name is 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol.

Molecular Properties

Compound Name5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol
PubChem CID89202826
Molecular FormulaC7H5F7O
Molecular Weight238.10 g/mol
Exact Mass238.02
IUPAC Name5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol
SMILESOC1(C(F)(F)F)C=CCC1(F)C(F)(F)F
InChIInChI=1S/C7H5F7O/c8-4(6(9,10)11)2-1-3-5(4,15)7(12,13)14/h1,3,15H,2H2
InChIKeyRHRMPUVEAJBWRI-UHFFFAOYSA-N
XLogP2.51
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.10
LogP ≤ 52.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol 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

1,2,2,3-Tetrakis(trifluoromethyl)cyclopent-4-ene-1,3-diol
CID 21062411
1,5,5-Tris(trifluoromethyl)cyclopent-2-en-1-ol
CID 21062412
2-Cyclopent-3-en-1-yl-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 21062416
2,2-Difluoro-1,3-bis(trifluoromethyl)cyclopent-4-ene-1,3-diol
CID 21062454
5,5-Difluoro-1-(trifluoromethyl)cyclopent-2-en-1-ol
CID 21062455
1,3-Bis(trifluoromethyl)cyclopent-4-ene-1,3-diol
CID 89202827
Ethane;1,5,5-tris(trifluoromethyl)cyclopent-2-en-1-ol
CID 91062180
1-(Trifluoromethyl)cyclopent-2-en-1-ol
CID 141208332
2-Cyclopenta-1,3-dien-1-yl-1,1,1,3,3,3-hexafluoropropan-2-ol
CID 139147631

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol?
The IUPAC name of 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol (CID 89202826) is 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol.
What is the SMILES notation for 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol?
The canonical SMILES for 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol is OC1(C(F)(F)F)C=CCC1(F)C(F)(F)F.
What is the InChIKey of 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol?
The InChIKey is RHRMPUVEAJBWRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F7O/c8-4(6(9,10)11)2-1-3-5(4,15)7(12,13)14/h1,3,15H,2H2.
What are the key properties of 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol?
5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol has a molecular weight of 238.10 g/mol, XLogP of 2.51, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-1,5-bis(trifluoromethyl)cyclopent-2-en-1-ol is sourced from PubChem (CID 89202826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).