[(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite

C8H11FO — CID 143873203

IUPAC[(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite
SMILESC=C/C=C\C(=C/C)COF
InChIInChI=1S/C8H11FO/c1-3-5-6-8(4-2)7-10-9/h3-6H,1,7H2,2H3/b6-5-,8-4+
InChIKeyTVOAGGDTKAWKJZ-QNMAEOQASA-N
MW142.17 g/mol
LogP2.58
Rot. Bonds4

About [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite

[(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite (PubChem CID 143873203) has the molecular formula C8H11FO and a molecular weight of 142.17 g/mol. Its IUPAC name is [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite.

Molecular Properties

Compound Name[(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite
PubChem CID143873203
Molecular FormulaC8H11FO
Molecular Weight142.17 g/mol
Exact Mass142.08
IUPAC Name[(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite
SMILESC=C/C=C\C(=C/C)COF
InChIInChI=1S/C8H11FO/c1-3-5-6-8(4-2)7-10-9/h3-6H,1,7H2,2H3/b6-5-,8-4+
InChIKeyTVOAGGDTKAWKJZ-QNMAEOQASA-N
XLogP2.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.17
LogP ≤ 52.58
H-Bond Donors ≤ 50
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,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite?
The IUPAC name of [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite (CID 143873203) is [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite.
What is the SMILES notation for [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite?
The canonical SMILES for [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite is C=C/C=C\C(=C/C)COF.
What is the InChIKey of [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite?
The InChIKey is TVOAGGDTKAWKJZ-QNMAEOQASA-N. The full InChI is InChI=1S/C8H11FO/c1-3-5-6-8(4-2)7-10-9/h3-6H,1,7H2,2H3/b6-5-,8-4+.
What are the key properties of [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite?
[(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite has a molecular weight of 142.17 g/mol, XLogP of 2.58, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(2E,3Z)-2-ethylidenehexa-3,5-dienyl] hypofluorite is sourced from PubChem (CID 143873203), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).