(3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane

C14H20Si2 — CID 11810726

IUPAC(3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane
SMILESC#CC1=C(C#C)C([Si](C)(C)C)=C1[Si](C)(C)C
InChIInChI=1S/C14H20Si2/c1-9-11-12(10-2)14(16(6,7)8)13(11)15(3,4)5/h1-2H,3-8H3
InChIKeyUIJQMEILEQNLIL-UHFFFAOYSA-N
MW244.49 g/mol
LogP3.61
Rot. Bonds2

About (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane

(3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane (PubChem CID 11810726) has the molecular formula C14H20Si2 and a molecular weight of 244.49 g/mol. Its IUPAC name is (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane.

Molecular Properties

Compound Name(3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane
PubChem CID11810726
Molecular FormulaC14H20Si2
Molecular Weight244.49 g/mol
Exact Mass244.11
IUPAC Name(3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane
SMILESC#CC1=C(C#C)C([Si](C)(C)C)=C1[Si](C)(C)C
InChIInChI=1S/C14H20Si2/c1-9-11-12(10-2)14(16(6,7)8)13(11)15(3,4)5/h1-2H,3-8H3
InChIKeyUIJQMEILEQNLIL-UHFFFAOYSA-N
XLogP3.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.49
LogP ≤ 53.61
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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Related Compounds

Trimethyl-[2-[2,3,4-tris(trimethylsilyl)cyclobuta-1,3-dien-1-yl]ethynyl]silane
CID 13573337
Trimethyl-[3-trimethylsilyl-2,4-bis(2-trimethylsilylethynyl)cyclobuta-1,3-dien-1-yl]silane
CID 15912758
Trimethyl-[5-methyl-3-propan-2-ylidene-4-(2-trimethylsilylethynyl)hex-4-en-1-ynyl]silane
CID 154721354
Trimethyl-[3-propan-2-ylidene-4-(2-trimethylsilylethynyl)hex-4-en-1-ynyl]silane
CID 154721469
2-(2-Ethynylcyclobuta-1,3-dien-1-yl)ethynyl-trimethylsilane
CID 10881504
CID 11810725
CID 11810725
4-[3,4-Diethynyl-2-[4-tri(propan-2-yl)silylbuta-1,3-diynyl]cyclobuta-1,3-dien-1-yl]buta-1,3-diynyl-tri(propan-2-yl)silane
CID 12011032
trimethyl-[(4Z,10Z)-16-trimethylsilyl-15-bicyclo[12.2.0]hexadeca-1(14),4,10,15-tetraen-2,6,8,12-tetraynyl]silane
CID 12061733
[2-Ethynyl-3,4-bis(trimethylsilyl)cyclobuta-1,3-dien-1-yl]-trimethylsilane
CID 13573345
[(Z)-3,4-diethyl-6-trimethylsilylhex-3-en-1,5-diynyl]-trimethylsilane
CID 15448262
(2,4-Diethynyl-3-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane
CID 15784008
[2-Ethynyl-4-[4-[3-ethynyl-2,4-bis(trimethylsilyl)cyclobuta-1,3-dien-1-yl]buta-1,3-diynyl]-3-trimethylsilylcyclobuta-1,3-dien-1-yl]-trimethylsilane
CID 15784010

Frequently Asked Questions

What is the IUPAC name of (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane?
The IUPAC name of (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane (CID 11810726) is (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane.
What is the SMILES notation for (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane?
The canonical SMILES for (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane is C#CC1=C(C#C)C([Si](C)(C)C)=C1[Si](C)(C)C.
What is the InChIKey of (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane?
The InChIKey is UIJQMEILEQNLIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20Si2/c1-9-11-12(10-2)14(16(6,7)8)13(11)15(3,4)5/h1-2H,3-8H3.
What are the key properties of (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane?
(3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane has a molecular weight of 244.49 g/mol, XLogP of 3.61, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-diethynyl-2-trimethylsilylcyclobuta-1,3-dien-1-yl)-trimethylsilane is sourced from PubChem (CID 11810726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).