tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane

C18H34Si2 — CID 10267182

IUPACtert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane
SMILESC=C=C(CC#C[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H34Si2/c1-12-16(20(10,11)18(5,6)7)14-13-15-19(8,9)17(2,3)4/h1,14H2,2-11H3
InChIKeyFAKFYSWDIGCPIT-UHFFFAOYSA-N
MW306.64 g/mol
LogP6.19
Rot. Bonds2

About tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane

tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane (PubChem CID 10267182) has the molecular formula C18H34Si2 and a molecular weight of 306.64 g/mol. Its IUPAC name is tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane
PubChem CID10267182
Molecular FormulaC18H34Si2
Molecular Weight306.64 g/mol
Exact Mass306.22
IUPAC Nametert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane
SMILESC=C=C(CC#C[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C18H34Si2/c1-12-16(20(10,11)18(5,6)7)14-13-15-19(8,9)17(2,3)4/h1,14H2,2-11H3
InChIKeyFAKFYSWDIGCPIT-UHFFFAOYSA-N
XLogP6.19
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500306.64
LogP ≤ 56.19
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-Dimethylidene-6-tri(propan-2-yl)silylhexa-1,5-diynyl]-tri(propan-2-yl)silane
CID 10835624
Tri(propan-2-yl)-[4-tri(propan-2-yl)silylhexa-4,5-dien-1-ynyl]silane
CID 10363007
Tris(2-methylpropyl)-[4-[tris(2-methylpropyl)silyl]hexa-4,5-dien-1-ynyl]silane
CID 10390165
trimethyl-[(3Z,4Z)-6-trimethylsilyl-3,4-bis(trimethylsilylmethylidene)hexa-1,5-diynyl]silane
CID 11429239
Trimethyl(4-trimethylsilylhexa-4,5-dien-1-ynyl)silane
CID 11775747
trimethyl-[(E)-2-triethylsilyl-4-trimethylsilylbut-1-en-3-ynyl]silane
CID 13484486
(3,4-Dimethylidene-6-trimethylsilylhexa-1,5-diynyl)-trimethylsilane
CID 15191381
Triethyl-[3-methyl-3-(2-triethylsilylethynyl)pent-4-en-1-ynyl]silane
CID 86059387
3,3-Bis(2-triethylsilylethynyl)pent-4-en-1-ynyl-triethylsilane
CID 102353043
1,2-Bis[tris[2,2-bis-[(trimethylsilyl)ethynyl]silylvinyl](methyl)silyl]ethane
CID 129766428
trimethyl-[(1Z)-3-trimethylsilyl-2-(2-trimethylsilylethynyl)buta-1,3-dienyl]silane
CID 135062174
Triethyl(6-trimethylsilylocta-6,7-dien-1-ynyl)silane
CID 164686292

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane?
The IUPAC name of tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane (CID 10267182) is tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane is C=C=C(CC#C[Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane?
The InChIKey is FAKFYSWDIGCPIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34Si2/c1-12-16(20(10,11)18(5,6)7)14-13-15-19(8,9)17(2,3)4/h1,14H2,2-11H3.
What are the key properties of tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane?
tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane has a molecular weight of 306.64 g/mol, XLogP of 6.19, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[4-[tert-butyl(dimethyl)silyl]hexa-4,5-dien-1-ynyl]-dimethylsilane is sourced from PubChem (CID 10267182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).