4-ethyl-3,3-difluoronon-1-ene

C11H20F2 — CID 138461471

IUPAC4-ethyl-3,3-difluoronon-1-ene
SMILESC=CC(F)(F)C(CC)CCCCC
InChIInChI=1S/C11H20F2/c1-4-7-8-9-10(5-2)11(12,13)6-3/h6,10H,3-5,7-9H2,1-2H3
InChIKeyGUTJKLMHFQRPHB-UHFFFAOYSA-N
MW190.28 g/mol
LogP4.41
Rot. Bonds7

About 4-ethyl-3,3-difluoronon-1-ene

4-ethyl-3,3-difluoronon-1-ene (PubChem CID 138461471) has the molecular formula C11H20F2 and a molecular weight of 190.28 g/mol. Its IUPAC name is 4-ethyl-3,3-difluoronon-1-ene.

Molecular Properties

Compound Name4-ethyl-3,3-difluoronon-1-ene
PubChem CID138461471
Molecular FormulaC11H20F2
Molecular Weight190.28 g/mol
Exact Mass190.15
IUPAC Name4-ethyl-3,3-difluoronon-1-ene
SMILESC=CC(F)(F)C(CC)CCCCC
InChIInChI=1S/C11H20F2/c1-4-7-8-9-10(5-2)11(12,13)6-3/h6,10H,3-5,7-9H2,1-2H3
InChIKeyGUTJKLMHFQRPHB-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.28
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-3,3-difluoronon-1-ene?
The IUPAC name of 4-ethyl-3,3-difluoronon-1-ene (CID 138461471) is 4-ethyl-3,3-difluoronon-1-ene.
What is the SMILES notation for 4-ethyl-3,3-difluoronon-1-ene?
The canonical SMILES for 4-ethyl-3,3-difluoronon-1-ene is C=CC(F)(F)C(CC)CCCCC.
What is the InChIKey of 4-ethyl-3,3-difluoronon-1-ene?
The InChIKey is GUTJKLMHFQRPHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20F2/c1-4-7-8-9-10(5-2)11(12,13)6-3/h6,10H,3-5,7-9H2,1-2H3.
What are the key properties of 4-ethyl-3,3-difluoronon-1-ene?
4-ethyl-3,3-difluoronon-1-ene has a molecular weight of 190.28 g/mol, XLogP of 4.41, 7 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-3,3-difluoronon-1-ene is sourced from PubChem (CID 138461471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).