tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane

C24H50O2Si2 — CID 101411883

IUPACtert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane
SMILESCCCCC1=C(O[Si](C)(C)C(C)(C)C)C(CCC)O[Si]1(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C24H50O2Si2/c1-14-16-18-20-21(26-27(12,13)22(3,4)5)19(17-15-2)25-28(20,23(6,7)8)24(9,10)11/h19H,14-18H2,1-13H3
InChIKeyQIBYEGUPPYKILF-UHFFFAOYSA-N
MW426.83 g/mol
LogP8.74
Rot. Bonds7

About tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane

tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane (PubChem CID 101411883) has the molecular formula C24H50O2Si2 and a molecular weight of 426.83 g/mol. Its IUPAC name is tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane.

Molecular Properties

Compound Nametert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane
PubChem CID101411883
Molecular FormulaC24H50O2Si2
Molecular Weight426.83 g/mol
Exact Mass426.33
IUPAC Nametert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane
SMILESCCCCC1=C(O[Si](C)(C)C(C)(C)C)C(CCC)O[Si]1(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C24H50O2Si2/c1-14-16-18-20-21(26-27(12,13)22(3,4)5)19(17-15-2)25-28(20,23(6,7)8)24(9,10)11/h19H,14-18H2,1-13H3
InChIKeyQIBYEGUPPYKILF-UHFFFAOYSA-N
XLogP8.74
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500426.83
LogP ≤ 58.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy-tri(propan-2-yl)silane
CID 101411882
tert-butyl-dimethyl-[(1S)-1-propyl-2-trimethylsilyloxybut-2-enoxy]silane
CID 140080816
tert-butyl-dimethyl-[(1R)-1-propyl-2-trimethylsilyloxybut-2-enoxy]silane
CID 140080829
Tert-butyl-[2-[tert-butyl(dimethyl)silyl]oxycyclohex-2-en-1-yl]oxy-dimethylsilane
CID 11198673
tert-butyl-[(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methylpent-3-en-3-yl]oxy-dimethylsilane
CID 11244870
(3-butyl-2,2-ditert-butyl-5-prop-2-enyl-5H-oxasilol-4-yl)oxy-tri(propan-2-yl)silane
CID 101411889
Tert-butyl-dimethyl-(2-methyl-3-trimethylsilyloxycyclopent-2-en-1-yl)oxysilane
CID 102435319

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane?
The IUPAC name of tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane (CID 101411883) is tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane.
What is the SMILES notation for tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane?
The canonical SMILES for tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane is CCCCC1=C(O[Si](C)(C)C(C)(C)C)C(CCC)O[Si]1(C(C)(C)C)C(C)(C)C.
What is the InChIKey of tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane?
The InChIKey is QIBYEGUPPYKILF-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H50O2Si2/c1-14-16-18-20-21(26-27(12,13)22(3,4)5)19(17-15-2)25-28(20,23(6,7)8)24(9,10)11/h19H,14-18H2,1-13H3.
What are the key properties of tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane?
tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane has a molecular weight of 426.83 g/mol, XLogP of 8.74, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[(3-butyl-2,2-ditert-butyl-5-propyl-5H-oxasilol-4-yl)oxy]-dimethylsilane is sourced from PubChem (CID 101411883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).