2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane

C11H22OSi — CID 173014028

IUPAC2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane
SMILESC#CCCCO[SiH2]C(C)(C)C(C)C
InChIInChI=1S/C11H22OSi/c1-6-7-8-9-12-13-11(4,5)10(2)3/h1,10H,7-9,13H2,2-5H3
InChIKeyAJLMCTNYQJQGHU-UHFFFAOYSA-N
MW198.38 g/mol
LogP2.35
Rot. Bonds6

About 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane

2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane (PubChem CID 173014028) has the molecular formula C11H22OSi and a molecular weight of 198.38 g/mol. Its IUPAC name is 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane.

Molecular Properties

Compound Name2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane
PubChem CID173014028
Molecular FormulaC11H22OSi
Molecular Weight198.38 g/mol
Exact Mass198.14
IUPAC Name2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane
SMILESC#CCCCO[SiH2]C(C)(C)C(C)C
InChIInChI=1S/C11H22OSi/c1-6-7-8-9-12-13-11(4,5)10(2)3/h1,10H,7-9,13H2,2-5H3
InChIKeyAJLMCTNYQJQGHU-UHFFFAOYSA-N
XLogP2.35
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.38
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

lithium;butoxy(2,3-dimethylbutan-2-yl)silane;hydride
CID 174817482
5-(2,3-dimethylbutan-2-ylsilyloxy)pentan-1-ol
CID 123280532
2,3-dimethylbutan-2-yl(ethoxy)silane
CID 123706979
2,3-dimethylbutan-2-yl(oct-1-yn-3-yloxy)silane
CID 123893001
1-but-3-ynoxy-1,1-difluoro-2-methylpropane
CID 58422619
5-pent-4-ynoxypent-1-yne
CID 57020380
2-hex-5-ynoxyhexane
CID 54235991
11-[(2-methylpropan-2-yl)oxy]undec-1-yne
CID 15673920
tert-butyl-[(2R)-hept-6-yn-2-yl]oxy-dimethylsilane
CID 25098862
12-methyltridec-1-yne
CID 10921423
tert-butyl-hexadec-15-ynoxy-dimethylsilane
CID 23073442
6-(2-methoxypropan-2-yloxy)hex-1-yne
CID 88653043

Frequently Asked Questions

What is the IUPAC name of 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane?
The IUPAC name of 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane (CID 173014028) is 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane.
What is the SMILES notation for 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane?
The canonical SMILES for 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane is C#CCCCO[SiH2]C(C)(C)C(C)C.
What is the InChIKey of 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane?
The InChIKey is AJLMCTNYQJQGHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22OSi/c1-6-7-8-9-12-13-11(4,5)10(2)3/h1,10H,7-9,13H2,2-5H3.
What are the key properties of 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane?
2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane has a molecular weight of 198.38 g/mol, XLogP of 2.35, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dimethylbutan-2-yl(pent-4-ynoxy)silane is sourced from PubChem (CID 173014028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).