4-(fluoromethoxy)non-3-ene

C10H19FO — CID 123823728

IUPAC4-(fluoromethoxy)non-3-ene
SMILESCCC=C(CCCCC)OCF
InChIInChI=1S/C10H19FO/c1-3-5-6-8-10(7-4-2)12-9-11/h7H,3-6,8-9H2,1-2H3
InChIKeyHTOFVNZICWLNHC-UHFFFAOYSA-N
MW174.26 g/mol
LogP3.80
Rot. Bonds7

About 4-(fluoromethoxy)non-3-ene

4-(fluoromethoxy)non-3-ene (PubChem CID 123823728) has the molecular formula C10H19FO and a molecular weight of 174.26 g/mol. Its IUPAC name is 4-(fluoromethoxy)non-3-ene.

Molecular Properties

Compound Name4-(fluoromethoxy)non-3-ene
PubChem CID123823728
Molecular FormulaC10H19FO
Molecular Weight174.26 g/mol
Exact Mass174.14
IUPAC Name4-(fluoromethoxy)non-3-ene
SMILESCCC=C(CCCCC)OCF
InChIInChI=1S/C10H19FO/c1-3-5-6-8-10(7-4-2)12-9-11/h7H,3-6,8-9H2,1-2H3
InChIKeyHTOFVNZICWLNHC-UHFFFAOYSA-N
XLogP3.80
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.26
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 4-(fluoromethoxy)non-3-ene?
The IUPAC name of 4-(fluoromethoxy)non-3-ene (CID 123823728) is 4-(fluoromethoxy)non-3-ene.
What is the SMILES notation for 4-(fluoromethoxy)non-3-ene?
The canonical SMILES for 4-(fluoromethoxy)non-3-ene is CCC=C(CCCCC)OCF.
What is the InChIKey of 4-(fluoromethoxy)non-3-ene?
The InChIKey is HTOFVNZICWLNHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19FO/c1-3-5-6-8-10(7-4-2)12-9-11/h7H,3-6,8-9H2,1-2H3.
What are the key properties of 4-(fluoromethoxy)non-3-ene?
4-(fluoromethoxy)non-3-ene has a molecular weight of 174.26 g/mol, XLogP of 3.80, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(fluoromethoxy)non-3-ene is sourced from PubChem (CID 123823728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).