tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane

C20H38O2Si2 — CID 150405703

IUPACtert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane
SMILESCC(C)(C)[SiH2]OC(C)(C)c1cccc(C(C)(C)O[SiH2]C(C)(C)C)c1
InChIInChI=1S/C20H38O2Si2/c1-17(2,3)23-21-19(7,8)15-12-11-13-16(14-15)20(9,10)22-24-18(4,5)6/h11-14H,23-24H2,1-10H3
InChIKeyHESFRGIQAIAPQU-UHFFFAOYSA-N
MW366.69 g/mol
LogP4.79
Rot. Bonds6

About tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane

tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane (PubChem CID 150405703) has the molecular formula C20H38O2Si2 and a molecular weight of 366.69 g/mol. Its IUPAC name is tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane.

Molecular Properties

Compound Nametert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane
PubChem CID150405703
Molecular FormulaC20H38O2Si2
Molecular Weight366.69 g/mol
Exact Mass366.24
IUPAC Nametert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane
SMILESCC(C)(C)[SiH2]OC(C)(C)c1cccc(C(C)(C)O[SiH2]C(C)(C)C)c1
InChIInChI=1S/C20H38O2Si2/c1-17(2,3)23-21-19(7,8)15-12-11-13-16(14-15)20(9,10)22-24-18(4,5)6/h11-14H,23-24H2,1-10H3
InChIKeyHESFRGIQAIAPQU-UHFFFAOYSA-N
XLogP4.79
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.69
LogP ≤ 54.79
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

tert-butyl-[2-(2-methyl-1-oxidopyridin-1-ium-4-yl)propan-2-yloxy]silane
CID 131729430
methyl 5-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]-1,3-oxazole-4-carboxylate
CID 131730002
1,3-bis(2-tert-butylperoxypropan-2-yl)benzene
CID 161027852
bis(2-phenylpropan-2-yloxy)silane
CID 173308139
2-[3-(2-cyanatopropan-2-yl)phenyl]propan-2-yl cyanate
CID 22146451
alumane;1,3-ditert-butylbenzene
CID 174392215
4-(2-tert-butylsilyloxypropan-2-yl)furan-2-carboxylic acid
CID 154430012
magnesium;1,3-ditert-butylbenzene;dibromide
CID 174717429
4-(2-tert-butylsilyloxypropan-2-yl)-6-methylpyridine-2-carbonitrile
CID 131729431
1,3-bis[2-(2-methylbut-3-en-2-ylperoxy)propan-2-yl]benzene
CID 19814593
2-(3-tert-butylphenyl)propan-2-yl hydrogen carbonate
CID 67162008
8-(2-tert-butylsilyloxypropan-2-yl)naphthalene-1-carbaldehyde
CID 137328531

Frequently Asked Questions

What is the IUPAC name of tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane?
The IUPAC name of tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane (CID 150405703) is tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane.
What is the SMILES notation for tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane?
The canonical SMILES for tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane is CC(C)(C)[SiH2]OC(C)(C)c1cccc(C(C)(C)O[SiH2]C(C)(C)C)c1.
What is the InChIKey of tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane?
The InChIKey is HESFRGIQAIAPQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H38O2Si2/c1-17(2,3)23-21-19(7,8)15-12-11-13-16(14-15)20(9,10)22-24-18(4,5)6/h11-14H,23-24H2,1-10H3.
What are the key properties of tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane?
tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane has a molecular weight of 366.69 g/mol, XLogP of 4.79, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-[2-[3-(2-tert-butylsilyloxypropan-2-yl)phenyl]propan-2-yloxy]silane is sourced from PubChem (CID 150405703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).