tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane

C21H40OSi2 — CID 11024906

IUPACtert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane
SMILESCCCCCC(/C=C/C=C\C#C[Si](C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C21H40OSi2/c1-10-11-14-17-20(22-24(8,9)21(2,3)4)18-15-12-13-16-19-23(5,6)7/h12-13,15,18,20H,10-11,14,17H2,1-9H3/b13-12-,18-15+
InChIKeyPVXWFVHHSGPBOH-PNYDDDKWSA-N
MW364.72 g/mol
LogP6.95
Rot. Bonds8

About tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane

tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane (PubChem CID 11024906) has the molecular formula C21H40OSi2 and a molecular weight of 364.72 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane
PubChem CID11024906
Molecular FormulaC21H40OSi2
Molecular Weight364.72 g/mol
Exact Mass364.26
IUPAC Nametert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane
SMILESCCCCCC(/C=C/C=C\C#C[Si](C)(C)C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C21H40OSi2/c1-10-11-14-17-20(22-24(8,9)21(2,3)4)18-15-12-13-16-19-23(5,6)7/h12-13,15,18,20H,10-11,14,17H2,1-9H3/b13-12-,18-15+
InChIKeyPVXWFVHHSGPBOH-PNYDDDKWSA-N
XLogP6.95
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.72
LogP ≤ 56.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

trimethyl-[(Z)-1-trimethylsilyldec-3-en-1-yn-5-yl]oxysilane
CID 146162964
tert-butyl-(1-iodooct-1-en-3-yloxy)-dimethylsilane
CID 53400857
4-[tert-butyl(dimethyl)silyl]oxyoct-2-enal
CID 71343055
tert-butyl-dimethyl-[(6S,7R,8Z)-7-methyltetradeca-8,10-dien-12-yn-6-yl]oxysilane
CID 173483439
(2S)-2-[tert-butyl(dimethyl)silyl]oxyheptanal
CID 10490533
tert-butyl-dimethyl-[(3R)-1-tributylstannyloct-1-en-3-yl]oxysilane
CID 173153144
2-[tert-butyl(dimethyl)silyl]oxytridecanal
CID 170917454
tert-butyl-[(5S,8E,10E,12R)-12-[tert-butyl(dimethyl)silyl]oxypentadeca-8,10-dien-5-yl]oxy-dimethylsilane
CID 141158621
(E,2S,3R,6R)-1,3,6-tris[[tert-butyl(dimethyl)silyl]oxy]octadec-4-en-2-amine
CID 11365820
tert-butyl-dimethyl-[(5S)-1-trimethylsilyldec-1-yn-5-yl]oxysilane
CID 72549741
ethyl (Z,4S)-4-[tert-butyl(dimethyl)silyl]oxyoct-2-enoate
CID 56641063
tert-butyl-[1-[(3Z)-deca-1,3-dien-5-yl]oxy-4-methylpent-3-en-2-yl]oxy-dimethylsilane
CID 11696305

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane?
The IUPAC name of tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane (CID 11024906) is tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane.
What is the SMILES notation for tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane?
The canonical SMILES for tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane is CCCCCC(/C=C/C=C\C#C[Si](C)(C)C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane?
The InChIKey is PVXWFVHHSGPBOH-PNYDDDKWSA-N. The full InChI is InChI=1S/C21H40OSi2/c1-10-11-14-17-20(22-24(8,9)21(2,3)4)18-15-12-13-16-19-23(5,6)7/h12-13,15,18,20H,10-11,14,17H2,1-9H3/b13-12-,18-15+.
What are the key properties of tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane?
tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane has a molecular weight of 364.72 g/mol, XLogP of 6.95, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(7E,9Z)-12-trimethylsilyldodeca-7,9-dien-11-yn-6-yl]oxysilane is sourced from PubChem (CID 11024906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).