tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane

C13H28OSi — CID 101446444

IUPACtert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane
SMILESC=C(C)C(CCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28OSi/c1-9-10-12(11(2)3)14-15(7,8)13(4,5)6/h12H,2,9-10H2,1,3-8H3
InChIKeyZHOJZLWLXLKPNU-UHFFFAOYSA-N
MW228.45 g/mol
LogP4.75
Rot. Bonds5

About tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane

tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane (PubChem CID 101446444) has the molecular formula C13H28OSi and a molecular weight of 228.45 g/mol. Its IUPAC name is tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane.

Molecular Properties

Compound Nametert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane
PubChem CID101446444
Molecular FormulaC13H28OSi
Molecular Weight228.45 g/mol
Exact Mass228.19
IUPAC Nametert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane
SMILESC=C(C)C(CCC)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C13H28OSi/c1-9-10-12(11(2)3)14-15(7,8)13(4,5)6/h12H,2,9-10H2,1,3-8H3
InChIKeyZHOJZLWLXLKPNU-UHFFFAOYSA-N
XLogP4.75
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.45
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl-(5-iodo-2-methylpent-1-en-3-yl)oxy-dimethylsilane
CID 53392287
tert-butyl-dimethyl-(3-methylbut-3-en-2-yloxy)silane
CID 15935934
3-[tert-butyl(dimethyl)silyl]oxyoctadecan-2-one
CID 46237114
3-methoxy-2-methylhex-1-ene
CID 123417422
3-hydroperoxy-2-methylhex-1-ene
CID 12949710
tert-butyl-hex-1-en-3-yloxy-dimethylsilane
CID 11206678
(3S)-3-[tert-butyl(dimethyl)silyl]oxy-5-hydroxypentan-2-one
CID 10633359
(2R)-2-[tert-butyl(dimethyl)silyl]oxybutanoic acid
CID 87507546
tert-butyl-[(Z)-1-iodo-3-methylnon-2-en-4-yl]oxy-dimethylsilane
CID 134846992
[(6Z)-11-[tert-butyl(dimethyl)silyl]oxy-12-cyano-5-methylidenetrideca-6,12-dien-4-yl] acetate
CID 102399529
3-[tert-butyl(dimethyl)silyl]oxy-2-ethylhexan-1-ol
CID 146163917
[tert-butyl(dimethyl)silyl] 2-[tert-butyl(dimethyl)silyl]oxybutanoate
CID 590026

Frequently Asked Questions

What is the IUPAC name of tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane?
The IUPAC name of tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane (CID 101446444) is tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane.
What is the SMILES notation for tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane?
The canonical SMILES for tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane is C=C(C)C(CCC)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane?
The InChIKey is ZHOJZLWLXLKPNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28OSi/c1-9-10-12(11(2)3)14-15(7,8)13(4,5)6/h12H,2,9-10H2,1,3-8H3.
What are the key properties of tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane?
tert-butyl-dimethyl-(2-methylhex-1-en-3-yloxy)silane has a molecular weight of 228.45 g/mol, XLogP of 4.75, 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-methylhex-1-en-3-yloxy)silane is sourced from PubChem (CID 101446444), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).