(Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol

C6H5F7O — CID 44717634

IUPAC(Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol
SMILESOC/C=C\C(F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H5F7O/c7-4(2-1-3-14,5(8,9)10)6(11,12)13/h1-2,14H,3H2/b2-1-
InChIKeyLJGTZTYTTFGFAE-UPHRSURJSA-N
MW226.09 g/mol
LogP2.37
Rot. Bonds2

About (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol

(Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol (PubChem CID 44717634) has the molecular formula C6H5F7O and a molecular weight of 226.09 g/mol. Its IUPAC name is (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol.

Molecular Properties

Compound Name(Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol
PubChem CID44717634
Molecular FormulaC6H5F7O
Molecular Weight226.09 g/mol
Exact Mass226.02
IUPAC Name(Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol
SMILESOC/C=C\C(F)(C(F)(F)F)C(F)(F)F
InChIInChI=1S/C6H5F7O/c7-4(2-1-3-14,5(8,9)10)6(11,12)13/h1-2,14H,3H2/b2-1-
InChIKeyLJGTZTYTTFGFAE-UPHRSURJSA-N
XLogP2.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.09
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4,5,5,5-Tetrafluoro-2-iodo-4-(trifluoromethyl)pent-2-en-1-ol
CID 614370
4,4,5,5,6,6,6-Heptafluorohex-2-en-1-ol
CID 2774915
4,4,5,5,6,6,7,7,7-Nonafluorohept-2-en-1-ol
CID 2775815
4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoronon-2-en-1-ol
CID 2776183
(2E)-4,4,5,5,6,6,6-Heptafluorohex-2-en-1-ol
CID 5708520
(2E)-4,4,5,5,6,6,7,7,7-Nonafluorohept-2-en-1-ol
CID 5708662
3-(Perfluoro-n-hexyl)prop-2-en-1-ol
CID 5708693
(2E)-4,5,5,5-Tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol
CID 5708735
(2Z)-4,5,5,5-Tetrafluoro-2-iodo-4-(trifluoromethyl)pent-2-en-1-ol
CID 5709621
(2Z)-4,4,5,5,6,6,7,7,8,8,9,9,9-Tridecafluoronon-2-en-1-ol
CID 14008837
4,5,5,5-Tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol
CID 2776809
3,4,4,5,5,6,6,6-Octafluorohex-2-en-1-ol
CID 162396605

Frequently Asked Questions

What is the IUPAC name of (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol?
The IUPAC name of (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol (CID 44717634) is (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol.
What is the SMILES notation for (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol?
The canonical SMILES for (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol is OC/C=C\C(F)(C(F)(F)F)C(F)(F)F.
What is the InChIKey of (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol?
The InChIKey is LJGTZTYTTFGFAE-UPHRSURJSA-N. The full InChI is InChI=1S/C6H5F7O/c7-4(2-1-3-14,5(8,9)10)6(11,12)13/h1-2,14H,3H2/b2-1-.
What are the key properties of (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol?
(Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol has a molecular weight of 226.09 g/mol, XLogP of 2.37, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-4,5,5,5-tetrafluoro-4-(trifluoromethyl)pent-2-en-1-ol is sourced from PubChem (CID 44717634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).