(2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol

C8H11FO — CID 143420567

IUPAC(2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol
SMILESC=C/C(CO)=C(/F)C(=C)C
InChIInChI=1S/C8H11FO/c1-4-7(5-10)8(9)6(2)3/h4,10H,1-2,5H2,3H3/b8-7-
InChIKeyQXKLJQOUWQOBMD-FPLPWBNLSA-N
MW142.17 g/mol
LogP1.96
Rot. Bonds3

About (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol

(2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol (PubChem CID 143420567) has the molecular formula C8H11FO and a molecular weight of 142.17 g/mol. Its IUPAC name is (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol.

Molecular Properties

Compound Name(2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol
PubChem CID143420567
Molecular FormulaC8H11FO
Molecular Weight142.17 g/mol
Exact Mass142.08
IUPAC Name(2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol
SMILESC=C/C(CO)=C(/F)C(=C)C
InChIInChI=1S/C8H11FO/c1-4-7(5-10)8(9)6(2)3/h4,10H,1-2,5H2,3H3/b8-7-
InChIKeyQXKLJQOUWQOBMD-FPLPWBNLSA-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'}

Analyze (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-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

Frequently Asked Questions

What is the IUPAC name of (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol?
The IUPAC name of (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol (CID 143420567) is (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol.
What is the SMILES notation for (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol?
The canonical SMILES for (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol is C=C/C(CO)=C(/F)C(=C)C.
What is the InChIKey of (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol?
The InChIKey is QXKLJQOUWQOBMD-FPLPWBNLSA-N. The full InChI is InChI=1S/C8H11FO/c1-4-7(5-10)8(9)6(2)3/h4,10H,1-2,5H2,3H3/b8-7-.
What are the key properties of (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol?
(2Z)-2-ethenyl-3-fluoro-4-methylpenta-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 (2Z)-2-ethenyl-3-fluoro-4-methylpenta-2,4-dien-1-ol is sourced from PubChem (CID 143420567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).