tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane

C20H38OSi — CID 134841889

IUPACtert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane
SMILESCCCCC/C=C\CCCC#CCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H38OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(5,6)20(2,3)4/h11-12H,7-10,13-15,18-19H2,1-6H3/b12-11-
InChIKeyOUZDUKFWUZIJJZ-QXMHVHEDSA-N
MW322.61 g/mol
LogP6.71
Rot. Bonds10

About tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane

tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane (PubChem CID 134841889) has the molecular formula C20H38OSi and a molecular weight of 322.61 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane
PubChem CID134841889
Molecular FormulaC20H38OSi
Molecular Weight322.61 g/mol
Exact Mass322.27
IUPAC Nametert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane
SMILESCCCCC/C=C\CCCC#CCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C20H38OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(5,6)20(2,3)4/h11-12H,7-10,13-15,18-19H2,1-6H3/b12-11-
InChIKeyOUZDUKFWUZIJJZ-QXMHVHEDSA-N
XLogP6.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds10
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500322.61
LogP ≤ 56.71
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': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

tert-butyl-dimethyl-[(Z)-tetracos-15-enoxy]silane
CID 6430267
tert-butyl-[(Z)-icos-5-enoxy]-dimethylsilane
CID 6430269
tert-butyl-dimethyl-[(E)-octadec-6-enoxy]silane
CID 6430282
tert-butyl-dimethyl-[(E)-undec-4-en-6-ynoxy]silane
CID 23240903
tert-butyl-dimethyl-[(Z)-non-6-enoxy]silane
CID 59602006
(Z)-12-[tert-butyl(dimethyl)silyl]oxydodec-8-enenitrile
CID 57331776
tert-butyl-hexacosoxy-dimethylsilane
CID 6430213
tert-butyl-[(10E,12Z)-hexadeca-10,12-dienoxy]-dimethylsilane
CID 11371613
(Z,6R)-1-[tert-butyl(dimethyl)silyl]oxypentacos-16-en-2,4-diyn-6-ol
CID 11179314
(E)-1-[tert-butyl(dimethyl)silyl]oxyundec-5-en-2-ol
CID 100961334
(4S,13Z,16Z)-1-[tert-butyl(dimethyl)silyl]oxydocosa-13,16-dien-4-ol
CID 125481290
tert-butyl-dimethyl-[11-(3-pentyloxiran-2-yl)undec-6-ynoxy]silane
CID 59341246

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane (CID 134841889) is tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane is CCCCC/C=C\CCCC#CCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane?
The InChIKey is OUZDUKFWUZIJJZ-QXMHVHEDSA-N. The full InChI is InChI=1S/C20H38OSi/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-21-22(5,6)20(2,3)4/h11-12H,7-10,13-15,18-19H2,1-6H3/b12-11-.
What are the key properties of tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane?
tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane has a molecular weight of 322.61 g/mol, XLogP of 6.71, 10 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(Z)-tetradec-8-en-3-ynoxy]silane is sourced from PubChem (CID 134841889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).