(5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol

C11H16F2O — CID 143216976

IUPAC(5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol
SMILESC=C/C=C\C(=C/C)C(F)(F)CCCO
InChIInChI=1S/C11H16F2O/c1-3-5-7-10(4-2)11(12,13)8-6-9-14/h3-5,7,14H,1,6,8-9H2,2H3/b7-5-,10-4+
InChIKeyUIOHRHIMEUYYCJ-ACUVPTBSSA-N
MW202.24 g/mol
LogP3.08
Rot. Bonds6

About (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol

(5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol (PubChem CID 143216976) has the molecular formula C11H16F2O and a molecular weight of 202.24 g/mol. Its IUPAC name is (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol.

Molecular Properties

Compound Name(5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol
PubChem CID143216976
Molecular FormulaC11H16F2O
Molecular Weight202.24 g/mol
Exact Mass202.12
IUPAC Name(5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol
SMILESC=C/C=C\C(=C/C)C(F)(F)CCCO
InChIInChI=1S/C11H16F2O/c1-3-5-7-10(4-2)11(12,13)8-6-9-14/h3-5,7,14H,1,6,8-9H2,2H3/b7-5-,10-4+
InChIKeyUIOHRHIMEUYYCJ-ACUVPTBSSA-N
XLogP3.08
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.24
LogP ≤ 53.08
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 (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol?
The IUPAC name of (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol (CID 143216976) is (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol.
What is the SMILES notation for (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol?
The canonical SMILES for (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol is C=C/C=C\C(=C/C)C(F)(F)CCCO.
What is the InChIKey of (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol?
The InChIKey is UIOHRHIMEUYYCJ-ACUVPTBSSA-N. The full InChI is InChI=1S/C11H16F2O/c1-3-5-7-10(4-2)11(12,13)8-6-9-14/h3-5,7,14H,1,6,8-9H2,2H3/b7-5-,10-4+.
What are the key properties of (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol?
(5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol has a molecular weight of 202.24 g/mol, XLogP of 3.08, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5E,6Z)-5-ethylidene-4,4-difluoronona-6,8-dien-1-ol is sourced from PubChem (CID 143216976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).