tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane

C20H38Si2 — CID 101039275

IUPACtert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)C1/C=C\C=C/C([Si](C)(C)C(C)(C)C)/C=C\1
InChIInChI=1S/C20H38Si2/c1-19(2,3)21(7,8)17-13-11-12-14-18(16-15-17)22(9,10)20(4,5)6/h11-18H,1-10H3/b13-11-,14-12-,16-15-
InChIKeyYUGOGPNGXGCYDN-DYVMWCOHSA-N
MW334.70 g/mol
LogP7.43
Rot. Bonds2

About tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane

tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane (PubChem CID 101039275) has the molecular formula C20H38Si2 and a molecular weight of 334.70 g/mol. Its IUPAC name is tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane
PubChem CID101039275
Molecular FormulaC20H38Si2
Molecular Weight334.70 g/mol
Exact Mass334.25
IUPAC Nametert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane
SMILESCC(C)(C)[Si](C)(C)C1/C=C\C=C/C([Si](C)(C)C(C)(C)C)/C=C\1
InChIInChI=1S/C20H38Si2/c1-19(2,3)21(7,8)17-13-11-12-14-18(16-15-17)22(9,10)20(4,5)6/h11-18H,1-10H3/b13-11-,14-12-,16-15-
InChIKeyYUGOGPNGXGCYDN-DYVMWCOHSA-N
XLogP7.43
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.70
LogP ≤ 57.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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cyclopenta-2,4-dien-1-yl-dimethyl-[(E)-prop-1-enyl]silane
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tert-butyl-[(1R,4S)-4-methoxycyclopent-2-en-1-yl]oxy-dimethylsilane
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4-[tert-butyl(dimethyl)silyl]cyclopent-2-en-1-one
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tert-butyl-cyclopentyl-dimethylsilane
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(2Z,4Z,6Z)-9-tert-butyl-9-phosphabicyclo[6.1.0]nona-2,4,6-triene
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tert-butyl-[(2R,3R)-1-tert-butyl-3-[tert-butyl(dimethyl)silyl]phosphiran-2-yl]-dimethylsilane
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ditert-butyl-(dioxiran-3-yl)-methylsilane
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3-chloropropyl-di(cyclopenta-2,4-dien-1-yl)-methylsilane
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cyclopenta-2,4-dien-1-yl-methyl-diphenylsilane;titanium
CID 174994654
2-cyclopenta-2,4-dien-1-ylpropan-2-yl hypobromite
CID 167432979

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane?
The IUPAC name of tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane (CID 101039275) is tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane?
The canonical SMILES for tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane is CC(C)(C)[Si](C)(C)C1/C=C\C=C/C([Si](C)(C)C(C)(C)C)/C=C\1.
What is the InChIKey of tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane?
The InChIKey is YUGOGPNGXGCYDN-DYVMWCOHSA-N. The full InChI is InChI=1S/C20H38Si2/c1-19(2,3)21(7,8)17-13-11-12-14-18(16-15-17)22(9,10)20(4,5)6/h11-18H,1-10H3/b13-11-,14-12-,16-15-.
What are the key properties of tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane?
tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane has a molecular weight of 334.70 g/mol, XLogP of 7.43, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(2Z,4Z,7Z)-6-[tert-butyl(dimethyl)silyl]cycloocta-2,4,7-trien-1-yl]-dimethylsilane is sourced from PubChem (CID 101039275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).