cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane

C6H13AsO2S — CID 173088720

IUPACcyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane
SMILESO[AsH](=S)OC1CCCCC1
InChIInChI=1S/C6H13AsO2S/c8-7(10)9-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,8,10)
InChIKeyBLBJLIZXUALNKP-UHFFFAOYSA-N
MW224.16 g/mol
LogP1.24
Rot. Bonds2

About cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane

cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane (PubChem CID 173088720) has the molecular formula C6H13AsO2S and a molecular weight of 224.16 g/mol. Its IUPAC name is cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane.

Molecular Properties

Compound Namecyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane
PubChem CID173088720
Molecular FormulaC6H13AsO2S
Molecular Weight224.16 g/mol
Exact Mass223.99
IUPAC Namecyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane
SMILESO[AsH](=S)OC1CCCCC1
InChIInChI=1S/C6H13AsO2S/c8-7(10)9-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,8,10)
InChIKeyBLBJLIZXUALNKP-UHFFFAOYSA-N
XLogP1.24
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.16
LogP ≤ 51.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

cyclohexyloxyarsinic acid
CID 154070116
cyclohexane;hydroperoxycyclohexane
CID 88671084
8-cycloheptyloxyoctoxycycloheptane
CID 173292672
buta-1,3-dien-2-yloxycyclohexane
CID 142221806
1,4-bis[(4-cyclohexyloxycyclohexyl)oxy]cyclohexane
CID 140552812
cyclobutyloxycyclohexane
CID 89332762
cyclooctyl cyclooctanecarboxylate
CID 57160377
copper cyclohexylperoxy(dioxido)borane
CID 161435143
cyclopentyl N-cyclohexyloxycarbonyliminocarbamate
CID 140646211
zinc cyclohexyloxymethanedithioic acid
CID 54608999
potassium cyclodecyloxymethanedithioate
CID 157247255
cyclodecyloxyboronic acid
CID 57131416

Frequently Asked Questions

What is the IUPAC name of cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane?
The IUPAC name of cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane (CID 173088720) is cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane.
What is the SMILES notation for cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane?
The canonical SMILES for cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane is O[AsH](=S)OC1CCCCC1.
What is the InChIKey of cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane?
The InChIKey is BLBJLIZXUALNKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13AsO2S/c8-7(10)9-6-4-2-1-3-5-6/h6-7H,1-5H2,(H,8,10).
What are the key properties of cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane?
cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane has a molecular weight of 224.16 g/mol, XLogP of 1.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyloxy-hydroxy-sulfanylidene-λ5-arsane is sourced from PubChem (CID 173088720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).