2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane

C8H24As8O8 — CID 100926283

IUPAC2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane
SMILESC[As]1O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O1
InChIInChI=1S/C8H24As8O8/c1-9-17-10(2)19-12(4)21-14(6)23-16(8)24-15(7)22-13(5)20-11(3)18-9/h1-8H3
InChIKeyWKCCMUBIKSXNDE-UHFFFAOYSA-N
MW847.65 g/mol
LogP1.08
Rot. Bonds

About 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane

2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane (PubChem CID 100926283) has the molecular formula C8H24As8O8 and a molecular weight of 847.65 g/mol. Its IUPAC name is 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane.

Molecular Properties

Compound Name2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane
PubChem CID100926283
Molecular FormulaC8H24As8O8
Molecular Weight847.65 g/mol
Exact Mass847.52
IUPAC Name2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane
SMILESC[As]1O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O1
InChIInChI=1S/C8H24As8O8/c1-9-17-10(2)19-12(4)21-14(6)23-16(8)24-15(7)22-13(5)20-11(3)18-9/h1-8H3
InChIKeyWKCCMUBIKSXNDE-UHFFFAOYSA-N
XLogP1.08
TPSA73.84 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500847.65
LogP ≤ 51.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane?
The IUPAC name of 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane (CID 100926283) is 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane.
What is the SMILES notation for 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane?
The canonical SMILES for 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane is C[As]1O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O[As](C)O1.
What is the InChIKey of 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane?
The InChIKey is WKCCMUBIKSXNDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H24As8O8/c1-9-17-10(2)19-12(4)21-14(6)23-16(8)24-15(7)22-13(5)20-11(3)18-9/h1-8H3.
What are the key properties of 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane?
2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane has a molecular weight of 847.65 g/mol, XLogP of 1.08, 0 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6,8,10,12,14,16-octamethyl-1,3,5,7,9,11,13,15-octaoxa-2,4,6,8,10,12,14,16-octarsacyclohexadecane is sourced from PubChem (CID 100926283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).