2,2,3,3-tetrafluoropent-4-en-1-ol

C5H6F4O — CID 130122672

IUPAC2,2,3,3-tetrafluoropent-4-en-1-ol
SMILESC=CC(F)(F)C(F)(F)CO
InChIInChI=1S/C5H6F4O/c1-2-4(6,7)5(8,9)3-10/h2,10H,1,3H2
InChIKeyRDXHETMHMVZLPZ-UHFFFAOYSA-N
MW158.09 g/mol
LogP1.44
Rot. Bonds3

About 2,2,3,3-tetrafluoropent-4-en-1-ol

2,2,3,3-tetrafluoropent-4-en-1-ol (PubChem CID 130122672) has the molecular formula C5H6F4O and a molecular weight of 158.09 g/mol. Its IUPAC name is 2,2,3,3-tetrafluoropent-4-en-1-ol.

Molecular Properties

Compound Name2,2,3,3-tetrafluoropent-4-en-1-ol
PubChem CID130122672
Molecular FormulaC5H6F4O
Molecular Weight158.09 g/mol
Exact Mass158.04
IUPAC Name2,2,3,3-tetrafluoropent-4-en-1-ol
SMILESC=CC(F)(F)C(F)(F)CO
InChIInChI=1S/C5H6F4O/c1-2-4(6,7)5(8,9)3-10/h2,10H,1,3H2
InChIKeyRDXHETMHMVZLPZ-UHFFFAOYSA-N
XLogP1.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.09
LogP ≤ 51.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3,3,4,4,5,5,6-heptafluorohex-1-ene
CID 20793154
2,2,3,3,4,4,5,5-octafluorohexane-1,6-diol;bis(prop-2-enoate)
CID 53400248
3,3,4,4,5,5,6,6,7,7,8,8,9,9,10,10-hexadecafluorododeca-1,11-diene
CID 2737145
2-ethenyl-2-(hydroxymethyl)propane-1,3-diol
CID 21187086
bis(2,2,3,3,3-pentafluoropropan-1-ol);zinc
CID 22386022
2-ethenylpropane-1,2,3-triol
CID 130123389
3,3,4,4,5,5,6,6,7,7,8,8-dodecafluorodec-1-ene
CID 19913308
3,3,3-trifluoroprop-1-ene
CID 90915807
2,2,3,3,4,4,5,5,6,6,7,7-dodecafluorotetradec-13-en-1-ol
CID 121403327
(3S)-2,2,3,4,4,6,6,6-octafluoro-3,5,5-tris(trifluoromethyl)hexan-1-ol
CID 97290945
2,2-difluorohex-5-en-1-ol
CID 150546008
(3R)-2,2,3,4,4,6,6,6-octafluoro-3,5,5-tris(trifluoromethyl)hexan-1-ol
CID 98046573

Frequently Asked Questions

What is the IUPAC name of 2,2,3,3-tetrafluoropent-4-en-1-ol?
The IUPAC name of 2,2,3,3-tetrafluoropent-4-en-1-ol (CID 130122672) is 2,2,3,3-tetrafluoropent-4-en-1-ol.
What is the SMILES notation for 2,2,3,3-tetrafluoropent-4-en-1-ol?
The canonical SMILES for 2,2,3,3-tetrafluoropent-4-en-1-ol is C=CC(F)(F)C(F)(F)CO.
What is the InChIKey of 2,2,3,3-tetrafluoropent-4-en-1-ol?
The InChIKey is RDXHETMHMVZLPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6F4O/c1-2-4(6,7)5(8,9)3-10/h2,10H,1,3H2.
What are the key properties of 2,2,3,3-tetrafluoropent-4-en-1-ol?
2,2,3,3-tetrafluoropent-4-en-1-ol has a molecular weight of 158.09 g/mol, XLogP of 1.44, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,3,3-tetrafluoropent-4-en-1-ol is sourced from PubChem (CID 130122672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).