cyclohexyloxy(dimethyl)sulfanium

C8H17OS+ — CID 10519009

IUPACcyclohexyloxy(dimethyl)sulfanium
SMILESC[S+](C)OC1CCCCC1
InChIInChI=1S/C8H17OS/c1-10(2)9-8-6-4-3-5-7-8/h8H,3-7H2,1-2H3/q+1
InChIKeyNCZDPZZCAPUALQ-UHFFFAOYSA-N
MW161.29 g/mol
LogP2.13
Rot. Bonds2

About cyclohexyloxy(dimethyl)sulfanium

cyclohexyloxy(dimethyl)sulfanium (PubChem CID 10519009) has the molecular formula C8H17OS+ and a molecular weight of 161.29 g/mol. Its IUPAC name is cyclohexyloxy(dimethyl)sulfanium.

Molecular Properties

Compound Namecyclohexyloxy(dimethyl)sulfanium
PubChem CID10519009
Molecular FormulaC8H17OS+
Molecular Weight161.29 g/mol
Exact Mass161.10
IUPAC Namecyclohexyloxy(dimethyl)sulfanium
SMILESC[S+](C)OC1CCCCC1
InChIInChI=1S/C8H17OS/c1-10(2)9-8-6-4-3-5-7-8/h8H,3-7H2,1-2H3/q+1
InChIKeyNCZDPZZCAPUALQ-UHFFFAOYSA-N
XLogP2.13
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.29
LogP ≤ 52.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

cyclopentyloxy(dimethyl)sulfanium
CID 87072730
dimethyl-[(1S,2S)-2-methylcyclohexyl]oxysulfanium
CID 10778753
methoxycyclooctane
CID 551195
1,4-bis[(4-cyclohexyloxycyclohexyl)oxy]cyclohexane
CID 140552812
cyclohexyl(dicyclopentyl)sulfanium;iodide;hydroiodide
CID 173457122
cyclobutyloxycyclohexane
CID 89332762
N-cyclohexyloxypropan-2-imine
CID 130635287
propan-2-yloxycycloundecane
CID 91254526
ethoxycyclooctane
CID 13427982
cyclohexyloxy(dimethyl)silane
CID 575341
formaldehyde;methoxycyclohexane
CID 142252216
methoxycyclopentane;dihydrate
CID 159895201

Frequently Asked Questions

What is the IUPAC name of cyclohexyloxy(dimethyl)sulfanium?
The IUPAC name of cyclohexyloxy(dimethyl)sulfanium (CID 10519009) is cyclohexyloxy(dimethyl)sulfanium.
What is the SMILES notation for cyclohexyloxy(dimethyl)sulfanium?
The canonical SMILES for cyclohexyloxy(dimethyl)sulfanium is C[S+](C)OC1CCCCC1.
What is the InChIKey of cyclohexyloxy(dimethyl)sulfanium?
The InChIKey is NCZDPZZCAPUALQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17OS/c1-10(2)9-8-6-4-3-5-7-8/h8H,3-7H2,1-2H3/q+1.
What are the key properties of cyclohexyloxy(dimethyl)sulfanium?
cyclohexyloxy(dimethyl)sulfanium has a molecular weight of 161.29 g/mol, XLogP of 2.13, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyloxy(dimethyl)sulfanium is sourced from PubChem (CID 10519009), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).