trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane

C20H32Si2 — CID 10917651

IUPACtrimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane
SMILESCC(C)[Si](C#CC1=C(C#C[Si](C)(C)C)C=C1)(C(C)C)C(C)C
InChIInChI=1S/C20H32Si2/c1-16(2)22(17(3)4,18(5)6)15-13-20-11-10-19(20)12-14-21(7,8)9/h10-11,16-18H,1-9H3
InChIKeyPSIIBGPOZDFZTB-UHFFFAOYSA-N
MW328.65 g/mol
LogP5.95
Rot. Bonds3

About trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane

trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane (PubChem CID 10917651) has the molecular formula C20H32Si2 and a molecular weight of 328.65 g/mol. Its IUPAC name is trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane
PubChem CID10917651
Molecular FormulaC20H32Si2
Molecular Weight328.65 g/mol
Exact Mass328.20
IUPAC Nametrimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane
SMILESCC(C)[Si](C#CC1=C(C#C[Si](C)(C)C)C=C1)(C(C)C)C(C)C
InChIInChI=1S/C20H32Si2/c1-16(2)22(17(3)4,18(5)6)15-13-20-11-10-19(20)12-14-21(7,8)9/h10-11,16-18H,1-9H3
InChIKeyPSIIBGPOZDFZTB-UHFFFAOYSA-N
XLogP5.95
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500328.65
LogP ≤ 55.95
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

[3-(4,4-Dimethylcyclohexa-2,5-dien-1-ylidene)-5-trimethylsilylpenta-1,4-diynyl]-trimethylsilane
CID 11833948
trimethyl-[4-methyl-3-[(E)-2-trimethylsilylethenyl]pent-3-en-1-ynyl]silane
CID 14175474
[(4E,6E)-5,6-dimethyl-7-trimethylsilyldeca-1,4,6,9-tetraen-4-yl]-trimethylsilane
CID 11781753
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
[3-[4-[1,5-Bis(trimethylsilyl)penta-1,4-diyn-3-ylidene]cyclohexa-2,5-dien-1-ylidene]-5-trimethylsilylpenta-1,4-diynyl]-trimethylsilane
CID 15363836
trimethyl-[(4Z)-5-methyl-3-methylidenehepta-4,6-dien-1-ynyl]silane
CID 173466997
trimethyl-[(3E,5Z)-3-methylocta-3,5-dien-1-ynyl]silane
CID 173551754
[(3E,5Z)-3-ethylhepta-3,5-dien-1-ynyl]-trimethylsilane
CID 173553199
2-(2-Ethynylcyclobuta-1,3-dien-1-yl)ethynyl-trimethylsilane
CID 10881504

Frequently Asked Questions

What is the IUPAC name of trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane?
The IUPAC name of trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane (CID 10917651) is trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane.
What is the SMILES notation for trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane?
The canonical SMILES for trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane is CC(C)[Si](C#CC1=C(C#C[Si](C)(C)C)C=C1)(C(C)C)C(C)C.
What is the InChIKey of trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane?
The InChIKey is PSIIBGPOZDFZTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H32Si2/c1-16(2)22(17(3)4,18(5)6)15-13-20-11-10-19(20)12-14-21(7,8)9/h10-11,16-18H,1-9H3.
What are the key properties of trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane?
trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane has a molecular weight of 328.65 g/mol, XLogP of 5.95, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-[2-[2-tri(propan-2-yl)silylethynyl]cyclobuta-1,3-dien-1-yl]ethynyl]silane is sourced from PubChem (CID 10917651), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).