[fluoro(methylsulfanyl)methyl]cyclohexane

C8H15FS — CID 89207462

IUPAC[fluoro(methylsulfanyl)methyl]cyclohexane
SMILESCSC(F)C1CCCCC1
InChIInChI=1S/C8H15FS/c1-10-8(9)7-5-3-2-4-6-7/h7-8H,2-6H2,1H3
InChIKeyVVXQMMWXQISJJA-UHFFFAOYSA-N
MW162.27 g/mol
LogP3.23
Rot. Bonds2

About [fluoro(methylsulfanyl)methyl]cyclohexane

[fluoro(methylsulfanyl)methyl]cyclohexane (PubChem CID 89207462) has the molecular formula C8H15FS and a molecular weight of 162.27 g/mol. Its IUPAC name is [fluoro(methylsulfanyl)methyl]cyclohexane.

Molecular Properties

Compound Name[fluoro(methylsulfanyl)methyl]cyclohexane
PubChem CID89207462
Molecular FormulaC8H15FS
Molecular Weight162.27 g/mol
Exact Mass162.09
IUPAC Name[fluoro(methylsulfanyl)methyl]cyclohexane
SMILESCSC(F)C1CCCCC1
InChIInChI=1S/C8H15FS/c1-10-8(9)7-5-3-2-4-6-7/h7-8H,2-6H2,1H3
InChIKeyVVXQMMWXQISJJA-UHFFFAOYSA-N
XLogP3.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.27
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of [fluoro(methylsulfanyl)methyl]cyclohexane?
The IUPAC name of [fluoro(methylsulfanyl)methyl]cyclohexane (CID 89207462) is [fluoro(methylsulfanyl)methyl]cyclohexane.
What is the SMILES notation for [fluoro(methylsulfanyl)methyl]cyclohexane?
The canonical SMILES for [fluoro(methylsulfanyl)methyl]cyclohexane is CSC(F)C1CCCCC1.
What is the InChIKey of [fluoro(methylsulfanyl)methyl]cyclohexane?
The InChIKey is VVXQMMWXQISJJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FS/c1-10-8(9)7-5-3-2-4-6-7/h7-8H,2-6H2,1H3.
What are the key properties of [fluoro(methylsulfanyl)methyl]cyclohexane?
[fluoro(methylsulfanyl)methyl]cyclohexane has a molecular weight of 162.27 g/mol, XLogP of 3.23, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [fluoro(methylsulfanyl)methyl]cyclohexane is sourced from PubChem (CID 89207462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).