(2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane

C17H40OSi2 — CID 123878427

IUPAC(2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane
SMILESCCC(C)(C)CC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)C
InChIInChI=1S/C17H40OSi2/c1-12-17(5,6)13-15(16(2,3)4)14-20(10,11)18-19(7,8)9/h15H,12-14H2,1-11H3
InChIKeyCDFPCBIDARKAOY-UHFFFAOYSA-N
MW316.68 g/mol
LogP6.53
Rot. Bonds7

About (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane

(2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane (PubChem CID 123878427) has the molecular formula C17H40OSi2 and a molecular weight of 316.68 g/mol. Its IUPAC name is (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane.

Molecular Properties

Compound Name(2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane
PubChem CID123878427
Molecular FormulaC17H40OSi2
Molecular Weight316.68 g/mol
Exact Mass316.26
IUPAC Name(2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane
SMILESCCC(C)(C)CC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)C
InChIInChI=1S/C17H40OSi2/c1-12-17(5,6)13-15(16(2,3)4)14-20(10,11)18-19(7,8)9/h15H,12-14H2,1-11H3
InChIKeyCDFPCBIDARKAOY-UHFFFAOYSA-N
XLogP6.53
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500316.68
LogP ≤ 56.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

Tris-tertiarybutyldimethylsilylether
CID 129724062
Tert-butyl-dimethoxy-(2,4,4,6,6-pentamethylheptyl)silane
CID 10925150
Butan-2-yl-dimethoxy-(2,4,4,6,6-pentamethylheptyl)silane
CID 19076224
Dimethoxy-(2-methylpropyl)-(2,4,4,6,6-pentamethylheptyl)silane
CID 19076225
Tris(2-ethyl-4-methylhexyl)-tris(2-ethyl-4-methylhexyl)silyloxysilane
CID 22223391
Dimethyl-trimethylsilyloxy-(2,4,6-trimethyl-7-trimethylsilylheptyl)silane
CID 54011018
Dimethoxy-(2,4,4,6,6-pentamethylheptyl)-propan-2-ylsilane
CID 54205248
Dimethyl-(4-methyl-7-trimethylsilylheptyl)-trimethylsilyloxysilane
CID 54334196
(3-Tert-butyl-2,2,4,4-tetramethylpentan-3-yl)-methyl-bis(trimethylsilyloxy)silane
CID 57723615
[10-[Dimethyl(trimethylsilyloxy)silyl]-2,2-dimethyldecyl]-dimethyl-trimethylsilyloxysilane
CID 58159321
[1-[Ethyl(oxo)silyl]-2,2,3-trimethylnonadecan-3-yl]-trimethylsilane
CID 58412260
Trimethyl-(2,2,4-trimethyl-1-trimethylsilyltetradecan-4-yl)silane
CID 59060000

Frequently Asked Questions

What is the IUPAC name of (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane?
The IUPAC name of (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane (CID 123878427) is (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane.
What is the SMILES notation for (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane?
The canonical SMILES for (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane is CCC(C)(C)CC(C[Si](C)(C)O[Si](C)(C)C)C(C)(C)C.
What is the InChIKey of (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane?
The InChIKey is CDFPCBIDARKAOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H40OSi2/c1-12-17(5,6)13-15(16(2,3)4)14-20(10,11)18-19(7,8)9/h15H,12-14H2,1-11H3.
What are the key properties of (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane?
(2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane has a molecular weight of 316.68 g/mol, XLogP of 6.53, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2-tert-butyl-4,4-dimethylhexyl)-dimethyl-trimethylsilyloxysilane is sourced from PubChem (CID 123878427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).