2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane

C20H60O10Si10 — CID 123706901

IUPAC2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane
SMILESCC[Si]1(CC)O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[Si](CC)(CC)O[Si](CC)(CC)O[Si](CC)(CC)O[Si](CC)(CC)O1
InChIInChI=1S/C20H60O10Si10/c1-11-36(12-2)25-34-23-32-21-31-22-33-24-35-26-37(13-3,14-4)28-39(17-7,18-8)30-40(19-9,20-10)29-38(15-5,16-6)27-36/h11-20,31-35H2,1-10H3
InChIKeySTXCLQJYDCIKTJ-UHFFFAOYSA-N
MW741.55 g/mol
LogP2.57
Rot. Bonds10

About 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane

2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane (PubChem CID 123706901) has the molecular formula C20H60O10Si10 and a molecular weight of 741.55 g/mol. Its IUPAC name is 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane.

Molecular Properties

Compound Name2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane
PubChem CID123706901
Molecular FormulaC20H60O10Si10
Molecular Weight741.55 g/mol
Exact Mass740.19
IUPAC Name2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane
SMILESCC[Si]1(CC)O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[Si](CC)(CC)O[Si](CC)(CC)O[Si](CC)(CC)O[Si](CC)(CC)O1
InChIInChI=1S/C20H60O10Si10/c1-11-36(12-2)25-34-23-32-21-31-22-33-24-35-26-37(13-3,14-4)28-39(17-7,18-8)30-40(19-9,20-10)29-38(15-5,16-6)27-36/h11-20,31-35H2,1-10H3
InChIKeySTXCLQJYDCIKTJ-UHFFFAOYSA-N
XLogP2.57
TPSA92.30 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds10
Heavy Atoms40
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500741.55
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

Analyze 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane?
The IUPAC name of 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane (CID 123706901) is 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane.
What is the SMILES notation for 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane?
The canonical SMILES for 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane is CC[Si]1(CC)O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[SiH2]O[Si](CC)(CC)O[Si](CC)(CC)O[Si](CC)(CC)O[Si](CC)(CC)O1.
What is the InChIKey of 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane?
The InChIKey is STXCLQJYDCIKTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H60O10Si10/c1-11-36(12-2)25-34-23-32-21-31-22-33-24-35-26-37(13-3,14-4)28-39(17-7,18-8)30-40(19-9,20-10)29-38(15-5,16-6)27-36/h11-20,31-35H2,1-10H3.
What are the key properties of 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane?
2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane has a molecular weight of 741.55 g/mol, XLogP of 2.57, 10 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,4,4,6,6,8,8,10,10-decaethyl-1,3,5,7,9,11,13,15,17,19-decaoxa-2,4,6,8,10,12,14,16,18,20-decasilacycloicosane is sourced from PubChem (CID 123706901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).