tert-butyl-diphenyl-undec-10-enoxysilane

C27H40OSi — CID 25058521

IUPACtert-butyl-diphenyl-undec-10-enoxysilane
SMILESC=CCCCCCCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C27H40OSi/c1-5-6-7-8-9-10-11-12-19-24-28-29(27(2,3)4,25-20-15-13-16-21-25)26-22-17-14-18-23-26/h5,13-18,20-23H,1,6-12,19,24H2,2-4H3
InChIKeyDJKHLSRKTKUXMW-UHFFFAOYSA-N
MW408.70 g/mol
LogP6.87
Rot. Bonds13

About tert-butyl-diphenyl-undec-10-enoxysilane

tert-butyl-diphenyl-undec-10-enoxysilane (PubChem CID 25058521) has the molecular formula C27H40OSi and a molecular weight of 408.70 g/mol. Its IUPAC name is tert-butyl-diphenyl-undec-10-enoxysilane.

Molecular Properties

Compound Nametert-butyl-diphenyl-undec-10-enoxysilane
PubChem CID25058521
Molecular FormulaC27H40OSi
Molecular Weight408.70 g/mol
Exact Mass408.28
IUPAC Nametert-butyl-diphenyl-undec-10-enoxysilane
SMILESC=CCCCCCCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C
InChIInChI=1S/C27H40OSi/c1-5-6-7-8-9-10-11-12-19-24-28-29(27(2,3)4,25-20-15-13-16-21-25)26-22-17-14-18-23-26/h5,13-18,20-23H,1,6-12,19,24H2,2-4H3
InChIKeyDJKHLSRKTKUXMW-UHFFFAOYSA-N
XLogP6.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds13
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500408.70
LogP ≤ 56.87
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'}

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Related Compounds

12-[tert-butyl(diphenyl)silyl]oxydodec-1-en-6-ol
CID 168962199
(Z)-11-[tert-butyl(diphenyl)silyl]oxyundec-5-en-1-ol
CID 90098390
tert-butyl-[(E)-dec-5-enoxy]-diphenylsilane
CID 11188599
tert-butyl-heptatriaconta-23,26-dienoxy-diphenylsilane
CID 69009078
12-[tert-butyl(diphenyl)silyl]oxydodecan-1-ol
CID 11015684
tert-butyl-(10-iododecoxy)-diphenylsilane
CID 10994946
tert-butyl-(5-iodopentoxy)-diphenylsilane
CID 10003991
8-bromooctoxy-tert-butyl-diphenylsilane
CID 22444390
tert-butyl-[(E)-heptadec-4-enoxy]-diphenylsilane
CID 11123858
(3S)-8-[tert-butyl(diphenyl)silyl]oxyoct-1-en-3-ol
CID 174143208
7-[tert-butyl(diphenyl)silyl]oxy-2-methylheptan-2-ol
CID 102173958
tert-butyl-diphenyl-[(2S)-undec-10-en-2-yl]oxysilane
CID 11988597

Frequently Asked Questions

What is the IUPAC name of tert-butyl-diphenyl-undec-10-enoxysilane?
The IUPAC name of tert-butyl-diphenyl-undec-10-enoxysilane (CID 25058521) is tert-butyl-diphenyl-undec-10-enoxysilane.
What is the SMILES notation for tert-butyl-diphenyl-undec-10-enoxysilane?
The canonical SMILES for tert-butyl-diphenyl-undec-10-enoxysilane is C=CCCCCCCCCCO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C.
What is the InChIKey of tert-butyl-diphenyl-undec-10-enoxysilane?
The InChIKey is DJKHLSRKTKUXMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H40OSi/c1-5-6-7-8-9-10-11-12-19-24-28-29(27(2,3)4,25-20-15-13-16-21-25)26-22-17-14-18-23-26/h5,13-18,20-23H,1,6-12,19,24H2,2-4H3.
What are the key properties of tert-butyl-diphenyl-undec-10-enoxysilane?
tert-butyl-diphenyl-undec-10-enoxysilane has a molecular weight of 408.70 g/mol, XLogP of 6.87, 13 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-diphenyl-undec-10-enoxysilane is sourced from PubChem (CID 25058521), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).