1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne

C16H32Si4 — CID 13446827

IUPAC1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne
SMILESC[Si]1(C)C#C[Si](C)(C)CC[Si](C)(C)C#C[Si](C)(C)CC1
InChIInChI=1S/C16H32Si4/c1-17(2)9-11-18(3,4)13-15-20(7,8)16-14-19(5,6)12-10-17/h9,11,14,16H2,1-8H3
InChIKeyAQUSVQUTBLGXHZ-UHFFFAOYSA-N
MW336.78 g/mol
LogP5.00
Rot. Bonds

About 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne

1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne (PubChem CID 13446827) has the molecular formula C16H32Si4 and a molecular weight of 336.78 g/mol. Its IUPAC name is 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne.

Molecular Properties

Compound Name1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne
PubChem CID13446827
Molecular FormulaC16H32Si4
Molecular Weight336.78 g/mol
Exact Mass336.16
IUPAC Name1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne
SMILESC[Si]1(C)C#C[Si](C)(C)CC[Si](C)(C)C#C[Si](C)(C)CC1
InChIInChI=1S/C16H32Si4/c1-17(2)9-11-18(3,4)13-15-20(7,8)16-14-19(5,6)12-10-17/h9,11,14,16H2,1-8H3
InChIKeyAQUSVQUTBLGXHZ-UHFFFAOYSA-N
XLogP5.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.78
LogP ≤ 55.00
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne?
The IUPAC name of 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne (CID 13446827) is 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne.
What is the SMILES notation for 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne?
The canonical SMILES for 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne is C[Si]1(C)C#C[Si](C)(C)CC[Si](C)(C)C#C[Si](C)(C)CC1.
What is the InChIKey of 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne?
The InChIKey is AQUSVQUTBLGXHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32Si4/c1-17(2)9-11-18(3,4)13-15-20(7,8)16-14-19(5,6)12-10-17/h9,11,14,16H2,1-8H3.
What are the key properties of 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne?
1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne has a molecular weight of 336.78 g/mol, XLogP of 5.00, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,4,4,7,7,10,10-octamethyl-1,4,7,10-tetrasilacyclododeca-5,11-diyne is sourced from PubChem (CID 13446827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).