tert-butyl-dimethyl-(2-methylpentoxy)silane

C12H28OSi — CID 86203641

IUPACtert-butyl-dimethyl-(2-methylpentoxy)silane
SMILESCCCC(C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H28OSi/c1-8-9-11(2)10-13-14(6,7)12(3,4)5/h11H,8-10H2,1-7H3
InChIKeyGSODTUHABDTPBR-UHFFFAOYSA-N
MW216.44 g/mol
LogP4.44
Rot. Bonds5

About tert-butyl-dimethyl-(2-methylpentoxy)silane

tert-butyl-dimethyl-(2-methylpentoxy)silane (PubChem CID 86203641) has the molecular formula C12H28OSi and a molecular weight of 216.44 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-methylpentoxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-methylpentoxy)silane
PubChem CID86203641
Molecular FormulaC12H28OSi
Molecular Weight216.44 g/mol
Exact Mass216.19
IUPAC Nametert-butyl-dimethyl-(2-methylpentoxy)silane
SMILESCCCC(C)CO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C12H28OSi/c1-8-9-11(2)10-13-14(6,7)12(3,4)5/h11H,8-10H2,1-7H3
InChIKeyGSODTUHABDTPBR-UHFFFAOYSA-N
XLogP4.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.44
LogP ≤ 54.44
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-methylpentoxy)silane?
The IUPAC name of tert-butyl-dimethyl-(2-methylpentoxy)silane (CID 86203641) is tert-butyl-dimethyl-(2-methylpentoxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2-methylpentoxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(2-methylpentoxy)silane is CCCC(C)CO[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(2-methylpentoxy)silane?
The InChIKey is GSODTUHABDTPBR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28OSi/c1-8-9-11(2)10-13-14(6,7)12(3,4)5/h11H,8-10H2,1-7H3.
What are the key properties of tert-butyl-dimethyl-(2-methylpentoxy)silane?
tert-butyl-dimethyl-(2-methylpentoxy)silane has a molecular weight of 216.44 g/mol, XLogP of 4.44, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-dimethyl-(2-methylpentoxy)silane is sourced from PubChem (CID 86203641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).