tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane

C12H28OSi — CID 87216085

IUPACtert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane
SMILESCCCC(C)(C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H28OSi/c1-9-10-12(5,6)13-14(7,8)11(2,3)4/h9-10H2,1-8H3
InChIKeyLOCNEUVHVRVPEU-UHFFFAOYSA-N
MW216.44 g/mol
LogP4.59
Rot. Bonds4

About tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane

tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane (PubChem CID 87216085) has the molecular formula C12H28OSi and a molecular weight of 216.44 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane
PubChem CID87216085
Molecular FormulaC12H28OSi
Molecular Weight216.44 g/mol
Exact Mass216.19
IUPAC Nametert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane
SMILESCCCC(C)(C)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H28OSi/c1-9-10-12(5,6)13-14(7,8)11(2,3)4/h9-10H2,1-8H3
InChIKeyLOCNEUVHVRVPEU-UHFFFAOYSA-N
XLogP4.59
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.44
LogP ≤ 54.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane (CID 87216085) is tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane is CCCC(C)(C)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane?
The InChIKey is LOCNEUVHVRVPEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28OSi/c1-9-10-12(5,6)13-14(7,8)11(2,3)4/h9-10H2,1-8H3.
What are the key properties of tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane?
tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane has a molecular weight of 216.44 g/mol, XLogP of 4.59, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-methylpentan-2-yloxy)silane is sourced from PubChem (CID 87216085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).