tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane

C23H48Si3 — CID 101103219

IUPACtert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane
SMILESCC(C)(C)C1=C(C(C)(C)C)C1=[Si]([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C23H48Si3/c1-20(2,3)17-18(21(4,5)6)19(17)24(25(13,14)22(7,8)9)26(15,16)23(10,11)12/h1-16H3
InChIKeyJYQKKPIWMIFSSC-UHFFFAOYSA-N
MW408.90 g/mol
LogP7.81
Rot. Bonds2

About tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane

tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane (PubChem CID 101103219) has the molecular formula C23H48Si3 and a molecular weight of 408.90 g/mol. Its IUPAC name is tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane
PubChem CID101103219
Molecular FormulaC23H48Si3
Molecular Weight408.90 g/mol
Exact Mass408.31
IUPAC Nametert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane
SMILESCC(C)(C)C1=C(C(C)(C)C)C1=[Si]([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C
InChIInChI=1S/C23H48Si3/c1-20(2,3)17-18(21(4,5)6)19(17)24(25(13,14)22(7,8)9)26(15,16)23(10,11)12/h1-16H3
InChIKeyJYQKKPIWMIFSSC-UHFFFAOYSA-N
XLogP7.81
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.90
LogP ≤ 57.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(1,2-Ditert-butyl-6,7-dimethyl-4-trimethylsilyl-4-silaspiro[2.5]octa-1,6-dien-4-yl)-trimethylsilane
CID 15785487
[5-[Dimethyl(3-methylbut-2-en-2-yl)silyl]-3,4,4-trimethylpent-2-en-2-yl]-dimethyl-[2-methyl-2-[2-(2-methyl-1-trimethylsilylpropan-2-yl)cyclopropyl]propyl]silane
CID 59963032
trimethyl-(1,2,3,4-tetratert-butyl-2H-silet-1-yl)silane
CID 10499172
CID 10618940
CID 10618940
[(Z)-5-[dimethyl(3-methylbut-2-en-2-yl)silyl]-3,4,4-trimethylpent-2-en-2-yl]-dimethyl-[2-methyl-2-[2-(2-methyl-1-trimethylsilylpropan-2-yl)cyclopropyl]propyl]silane
CID 20671407
CID 101022070
CID 101022070
Tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcyclopent-2-en-1-ylidene)silyl]-dimethylsilane
CID 101129918
Tert-butyl-[(2,3-ditert-butylcycloprop-2-en-1-yl)-bis(trimethylsilyl)silyl]oxy-dimethylsilane
CID 101176149
(2,3-Ditert-butylcycloprop-2-en-1-yl)-bis(trimethylsilyl)-trimethylsilyloxysilane
CID 101268995
[(2,3-Ditert-butylcycloprop-2-en-1-ylidene)-tri(propan-2-yl)silylsilyl]-tri(propan-2-yl)silane
CID 101357879
Tert-butyl-(2,3-ditert-butylcycloprop-2-en-1-yl)-trimethylsilyl-trimethylsilyloxysilane
CID 101534988
[(2,3-Ditert-butylcycloprop-2-en-1-ylidene)-trimethylsilylsilyl]-trimethylsilane
CID 101705617

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane?
The IUPAC name of tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane (CID 101103219) is tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane?
The canonical SMILES for tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane is CC(C)(C)C1=C(C(C)(C)C)C1=[Si]([Si](C)(C)C(C)(C)C)[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane?
The InChIKey is JYQKKPIWMIFSSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H48Si3/c1-20(2,3)17-18(21(4,5)6)19(17)24(25(13,14)22(7,8)9)26(15,16)23(10,11)12/h1-16H3.
What are the key properties of tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane?
tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane has a molecular weight of 408.90 g/mol, XLogP of 7.81, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[[tert-butyl(dimethyl)silyl]-(2,3-ditert-butylcycloprop-2-en-1-ylidene)silyl]-dimethylsilane is sourced from PubChem (CID 101103219), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).