(2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol

C8H11FO — CID 89416434

IUPAC(2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol
SMILESC/C=C\C(=C/C=C/F)CO
InChIInChI=1S/C8H11FO/c1-2-4-8(7-10)5-3-6-9/h2-6,10H,7H2,1H3/b4-2-,6-3+,8-5+
InChIKeyBZTDDVLQTVZUGS-VVLKWLIRSA-N
MW142.17 g/mol
LogP1.96
Rot. Bonds3

About (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol

(2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol (PubChem CID 89416434) has the molecular formula C8H11FO and a molecular weight of 142.17 g/mol. Its IUPAC name is (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol.

Molecular Properties

Compound Name(2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol
PubChem CID89416434
Molecular FormulaC8H11FO
Molecular Weight142.17 g/mol
Exact Mass142.08
IUPAC Name(2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol
SMILESC/C=C\C(=C/C=C/F)CO
InChIInChI=1S/C8H11FO/c1-2-4-8(7-10)5-3-6-9/h2-6,10H,7H2,1H3/b4-2-,6-3+,8-5+
InChIKeyBZTDDVLQTVZUGS-VVLKWLIRSA-N
XLogP1.96
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.17
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol?
The IUPAC name of (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol (CID 89416434) is (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol.
What is the SMILES notation for (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol?
The canonical SMILES for (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol is C/C=C\C(=C/C=C/F)CO.
What is the InChIKey of (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol?
The InChIKey is BZTDDVLQTVZUGS-VVLKWLIRSA-N. The full InChI is InChI=1S/C8H11FO/c1-2-4-8(7-10)5-3-6-9/h2-6,10H,7H2,1H3/b4-2-,6-3+,8-5+.
What are the key properties of (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol?
(2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol has a molecular weight of 142.17 g/mol, XLogP of 1.96, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2E,4E)-5-fluoro-2-[(Z)-prop-1-enyl]penta-2,4-dien-1-ol is sourced from PubChem (CID 89416434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).