nonyl thiohypofluorite

C9H19FS — CID 59366558

IUPACnonyl thiohypofluorite
SMILESCCCCCCCCCSF
InChIInChI=1S/C9H19FS/c1-2-3-4-5-6-7-8-9-11-10/h2-9H2,1H3
InChIKeyXELFUPABOKCGDQ-UHFFFAOYSA-N
MW178.32 g/mol
LogP4.35
Rot. Bonds8

About nonyl thiohypofluorite

nonyl thiohypofluorite (PubChem CID 59366558) has the molecular formula C9H19FS and a molecular weight of 178.32 g/mol. Its IUPAC name is nonyl thiohypofluorite.

Molecular Properties

Compound Namenonyl thiohypofluorite
PubChem CID59366558
Molecular FormulaC9H19FS
Molecular Weight178.32 g/mol
Exact Mass178.12
IUPAC Namenonyl thiohypofluorite
SMILESCCCCCCCCCSF
InChIInChI=1S/C9H19FS/c1-2-3-4-5-6-7-8-9-11-10/h2-9H2,1H3
InChIKeyXELFUPABOKCGDQ-UHFFFAOYSA-N
XLogP4.35
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.32
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze nonyl thiohypofluorite with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Octanethiol
CID 8144
1-Dodecanethiol
CID 8195
1-Decanethiol
CID 8917
1-Tetradecanethiol
CID 64677
1-Tridecanethiol
CID 29634
1-Nonanethiol
CID 15077
1-Undecanethiol
CID 62570
Dodecane-2-thiol
CID 85731
2-Octanethiol
CID 18145
Sodium dodecane-1-thiolate
CID 23672953
2-Nonanethiol
CID 518742
(2S)-Octane-2-thiol
CID 12397216

Frequently Asked Questions

What is the IUPAC name of nonyl thiohypofluorite?
The IUPAC name of nonyl thiohypofluorite (CID 59366558) is nonyl thiohypofluorite.
What is the SMILES notation for nonyl thiohypofluorite?
The canonical SMILES for nonyl thiohypofluorite is CCCCCCCCCSF.
What is the InChIKey of nonyl thiohypofluorite?
The InChIKey is XELFUPABOKCGDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19FS/c1-2-3-4-5-6-7-8-9-11-10/h2-9H2,1H3.
What are the key properties of nonyl thiohypofluorite?
nonyl thiohypofluorite has a molecular weight of 178.32 g/mol, XLogP of 4.35, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for nonyl thiohypofluorite is sourced from PubChem (CID 59366558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).