(E)-1-fluorooct-1-ene

C8H15F — CID 12517795

IUPAC(E)-1-fluorooct-1-ene
SMILESCCCCCC/C=C/F
InChIInChI=1S/C8H15F/c1-2-3-4-5-6-7-8-9/h7-8H,2-6H2,1H3/b8-7+
InChIKeyJONQIFYHXSUJDW-BQYQJAHWSA-N
MW130.21 g/mol
LogP3.44
Rot. Bonds5

About (E)-1-fluorooct-1-ene

(E)-1-fluorooct-1-ene (PubChem CID 12517795) has the molecular formula C8H15F and a molecular weight of 130.21 g/mol. Its IUPAC name is (E)-1-fluorooct-1-ene.

Molecular Properties

Compound Name(E)-1-fluorooct-1-ene
PubChem CID12517795
Molecular FormulaC8H15F
Molecular Weight130.21 g/mol
Exact Mass130.12
IUPAC Name(E)-1-fluorooct-1-ene
SMILESCCCCCC/C=C/F
InChIInChI=1S/C8H15F/c1-2-3-4-5-6-7-8-9/h7-8H,2-6H2,1H3/b8-7+
InChIKeyJONQIFYHXSUJDW-BQYQJAHWSA-N
XLogP3.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.21
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-1-fluorooct-1-ene?
The IUPAC name of (E)-1-fluorooct-1-ene (CID 12517795) is (E)-1-fluorooct-1-ene.
What is the SMILES notation for (E)-1-fluorooct-1-ene?
The canonical SMILES for (E)-1-fluorooct-1-ene is CCCCCC/C=C/F.
What is the InChIKey of (E)-1-fluorooct-1-ene?
The InChIKey is JONQIFYHXSUJDW-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H15F/c1-2-3-4-5-6-7-8-9/h7-8H,2-6H2,1H3/b8-7+.
What are the key properties of (E)-1-fluorooct-1-ene?
(E)-1-fluorooct-1-ene has a molecular weight of 130.21 g/mol, XLogP of 3.44, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-fluorooct-1-ene is sourced from PubChem (CID 12517795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).