tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane

C26H54OSi — CID 91697372

IUPACtert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane
SMILESC/C(=C\CO[Si](C)(C)C(C)(C)C)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C26H54OSi/c1-22(2)14-11-15-23(3)16-12-17-24(4)18-13-19-25(5)20-21-27-28(9,10)26(6,7)8/h20,22-24H,11-19,21H2,1-10H3/b25-20+
InChIKeyXACKPGHSEBHHTQ-LKUDQCMESA-N
MW410.80 g/mol
LogP9.39
Rot. Bonds15

About tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane

tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane (PubChem CID 91697372) has the molecular formula C26H54OSi and a molecular weight of 410.80 g/mol. Its IUPAC name is tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane
PubChem CID91697372
Molecular FormulaC26H54OSi
Molecular Weight410.80 g/mol
Exact Mass410.39
IUPAC Nametert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane
SMILESC/C(=C\CO[Si](C)(C)C(C)(C)C)CCCC(C)CCCC(C)CCCC(C)C
InChIInChI=1S/C26H54OSi/c1-22(2)14-11-15-23(3)16-12-17-24(4)18-13-19-25(5)20-21-27-28(9,10)26(6,7)8/h20,22-24H,11-19,21H2,1-10H3/b25-20+
InChIKeyXACKPGHSEBHHTQ-LKUDQCMESA-N
XLogP9.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.80
LogP ≤ 59.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane 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

1-Trimethylsiloxy-3,7,11,15-tetramethyl-2-hexadecene
CID 5372684
Retin, 15-[(trimethylsilyl)oxy]-, (11-cis,13-cis)-
CID 165362841
Phytyl tms ether
CID 129725731
Triethoxy[2-(4-methylcyclohex-3-en-1-yl)propyl]silane
CID 13650253
1-Triisobutylsilyloxyundec-2-ene
CID 5353181
trans-2-Decen-1-ol, tert-butyldimethylsilyl ether
CID 13033704
trans-2-Dodecen-1-ol, tert-butyldimethylsilyl ether
CID 91697346
tert-butyl-[(2E,4Z,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethylcyclohexen-1-yl)nona-2,4,6,8-tetraenoxy]-dimethylsilane
CID 10905468
tert-butyl-dimethyl-[(3S,4R)-2-methyl-4-(2-methylprop-1-enyl)octan-3-yl]oxysilane
CID 11045214
tert-butyl-dimethyl-[(5S,6R)-6-(2-methylprop-1-enyl)decan-5-yl]oxysilane
CID 11077915
[(E)-3-cyclohexylbut-2-enoxy]-trimethylsilane
CID 11964170
tert-butyl-[(E)-5-cycloheptylpent-4-enoxy]-dimethylsilane
CID 57332271

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane?
The IUPAC name of tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane (CID 91697372) is tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane.
What is the SMILES notation for tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane?
The canonical SMILES for tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane is C/C(=C\CO[Si](C)(C)C(C)(C)C)CCCC(C)CCCC(C)CCCC(C)C.
What is the InChIKey of tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane?
The InChIKey is XACKPGHSEBHHTQ-LKUDQCMESA-N. The full InChI is InChI=1S/C26H54OSi/c1-22(2)14-11-15-23(3)16-12-17-24(4)18-13-19-25(5)20-21-27-28(9,10)26(6,7)8/h20,22-24H,11-19,21H2,1-10H3/b25-20+.
What are the key properties of tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane?
tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane has a molecular weight of 410.80 g/mol, XLogP of 9.39, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-[(E)-3,7,11,15-tetramethylhexadec-2-enoxy]silane is sourced from PubChem (CID 91697372), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).