[2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane

C12H24O3Si — CID 123986696

IUPAC[2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane
SMILESCOC(=C(OC)C1([SiH3])CCCCO1)C(C)C
InChIInChI=1S/C12H24O3Si/c1-9(2)10(13-3)11(14-4)12(16)7-5-6-8-15-12/h9H,5-8H2,1-4,16H3
InChIKeyOQWNESLUIJYYJG-UHFFFAOYSA-N
MW244.41 g/mol
LogP1.41
Rot. Bonds4

About [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane

[2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane (PubChem CID 123986696) has the molecular formula C12H24O3Si and a molecular weight of 244.41 g/mol. Its IUPAC name is [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane.

Molecular Properties

Compound Name[2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane
PubChem CID123986696
Molecular FormulaC12H24O3Si
Molecular Weight244.41 g/mol
Exact Mass244.15
IUPAC Name[2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane
SMILESCOC(=C(OC)C1([SiH3])CCCCO1)C(C)C
InChIInChI=1S/C12H24O3Si/c1-9(2)10(13-3)11(14-4)12(16)7-5-6-8-15-12/h9H,5-8H2,1-4,16H3
InChIKeyOQWNESLUIJYYJG-UHFFFAOYSA-N
XLogP1.41
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.41
LogP ≤ 51.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane?
The IUPAC name of [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane (CID 123986696) is [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane.
What is the SMILES notation for [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane?
The canonical SMILES for [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane is COC(=C(OC)C1([SiH3])CCCCO1)C(C)C.
What is the InChIKey of [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane?
The InChIKey is OQWNESLUIJYYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O3Si/c1-9(2)10(13-3)11(14-4)12(16)7-5-6-8-15-12/h9H,5-8H2,1-4,16H3.
What are the key properties of [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane?
[2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane has a molecular weight of 244.41 g/mol, XLogP of 1.41, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(1,2-dimethoxy-3-methylbut-1-enyl)oxan-2-yl]silane is sourced from PubChem (CID 123986696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).