1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne

C12H20Si2 — CID 15835930

IUPAC1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne
SMILESC[Si]1(C)C#CCCC#C[Si](C)(C)CC1
InChIInChI=1S/C12H20Si2/c1-13(2)9-7-5-6-8-10-14(3,4)12-11-13/h5-6,11-12H2,1-4H3
InChIKeyRXQSBHBGJKSHNS-UHFFFAOYSA-N
MW220.46 g/mol
LogP3.28
Rot. Bonds

About 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne

1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne (PubChem CID 15835930) has the molecular formula C12H20Si2 and a molecular weight of 220.46 g/mol. Its IUPAC name is 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne.

Molecular Properties

Compound Name1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne
PubChem CID15835930
Molecular FormulaC12H20Si2
Molecular Weight220.46 g/mol
Exact Mass220.11
IUPAC Name1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne
SMILESC[Si]1(C)C#CCCC#C[Si](C)(C)CC1
InChIInChI=1S/C12H20Si2/c1-13(2)9-7-5-6-8-10-14(3,4)12-11-13/h5-6,11-12H2,1-4H3
InChIKeyRXQSBHBGJKSHNS-UHFFFAOYSA-N
XLogP3.28
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.46
LogP ≤ 53.28
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'}

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Frequently Asked Questions

What is the IUPAC name of 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne?
The IUPAC name of 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne (CID 15835930) is 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne.
What is the SMILES notation for 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne?
The canonical SMILES for 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne is C[Si]1(C)C#CCCC#C[Si](C)(C)CC1.
What is the InChIKey of 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne?
The InChIKey is RXQSBHBGJKSHNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20Si2/c1-13(2)9-7-5-6-8-10-14(3,4)12-11-13/h5-6,11-12H2,1-4H3.
What are the key properties of 1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne?
1,1,4,4-tetramethyl-1,4-disilacyclodeca-5,9-diyne has a molecular weight of 220.46 g/mol, XLogP of 3.28, 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-tetramethyl-1,4-disilacyclodeca-5,9-diyne is sourced from PubChem (CID 15835930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).