heptyl thiohypofluorite

C7H15FS — CID 59366553

IUPACheptyl thiohypofluorite
SMILESCCCCCCCSF
InChIInChI=1S/C7H15FS/c1-2-3-4-5-6-7-9-8/h2-7H2,1H3
InChIKeyQGVYVANFOLUONM-UHFFFAOYSA-N
MW150.26 g/mol
LogP3.57
Rot. Bonds6

About heptyl thiohypofluorite

heptyl thiohypofluorite (PubChem CID 59366553) has the molecular formula C7H15FS and a molecular weight of 150.26 g/mol. Its IUPAC name is heptyl thiohypofluorite.

Molecular Properties

Compound Nameheptyl thiohypofluorite
PubChem CID59366553
Molecular FormulaC7H15FS
Molecular Weight150.26 g/mol
Exact Mass150.09
IUPAC Nameheptyl thiohypofluorite
SMILESCCCCCCCSF
InChIInChI=1S/C7H15FS/c1-2-3-4-5-6-7-9-8/h2-7H2,1H3
InChIKeyQGVYVANFOLUONM-UHFFFAOYSA-N
XLogP3.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Heptanethial
CID 17856090
Hexyl thiohypofluorite
CID 59067997
Nonyl thiohypofluorite
CID 59366558
Pentyl thiohypofluorite
CID 87665741
Trifluoro(pentyl)-lambda4-sulfane
CID 87899636
Octyl thiohypofluorite
CID 88249869
Decyl thiohypofluorite
CID 88342358
1-Fluoroheptane-1-thiol
CID 124128602
Nonan-4-yl thiohypofluorite
CID 132045907
7-Fluoroheptane-3-thiol
CID 141945671
Hexan-2-yl thiohypofluorite
CID 154931702
Dodecyl thiohypofluorite
CID 172202320

Frequently Asked Questions

What is the IUPAC name of heptyl thiohypofluorite?
The IUPAC name of heptyl thiohypofluorite (CID 59366553) is heptyl thiohypofluorite.
What is the SMILES notation for heptyl thiohypofluorite?
The canonical SMILES for heptyl thiohypofluorite is CCCCCCCSF.
What is the InChIKey of heptyl thiohypofluorite?
The InChIKey is QGVYVANFOLUONM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15FS/c1-2-3-4-5-6-7-9-8/h2-7H2,1H3.
What are the key properties of heptyl thiohypofluorite?
heptyl thiohypofluorite has a molecular weight of 150.26 g/mol, XLogP of 3.57, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for heptyl thiohypofluorite is sourced from PubChem (CID 59366553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).