2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane

C13H28O2Si — CID 173186996

IUPAC2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane
SMILESC=CC(C)(C)[SiH](OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C13H28O2Si/c1-10-13(8,9)16(14-11(2,3)4)15-12(5,6)7/h10,16H,1H2,2-9H3
InChIKeyXVGMMZHVCYJHTA-UHFFFAOYSA-N
MW244.45 g/mol
LogP3.80
Rot. Bonds4

About 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane

2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane (PubChem CID 173186996) has the molecular formula C13H28O2Si and a molecular weight of 244.45 g/mol. Its IUPAC name is 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane.

Molecular Properties

Compound Name2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane
PubChem CID173186996
Molecular FormulaC13H28O2Si
Molecular Weight244.45 g/mol
Exact Mass244.19
IUPAC Name2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane
SMILESC=CC(C)(C)[SiH](OC(C)(C)C)OC(C)(C)C
InChIInChI=1S/C13H28O2Si/c1-10-13(8,9)16(14-11(2,3)4)15-12(5,6)7/h10,16H,1H2,2-9H3
InChIKeyXVGMMZHVCYJHTA-UHFFFAOYSA-N
XLogP3.80
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.45
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane?
The IUPAC name of 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane (CID 173186996) is 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane.
What is the SMILES notation for 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane?
The canonical SMILES for 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane is C=CC(C)(C)[SiH](OC(C)(C)C)OC(C)(C)C.
What is the InChIKey of 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane?
The InChIKey is XVGMMZHVCYJHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O2Si/c1-10-13(8,9)16(14-11(2,3)4)15-12(5,6)7/h10,16H,1H2,2-9H3.
What are the key properties of 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane?
2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane has a molecular weight of 244.45 g/mol, XLogP of 3.80, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylbut-3-en-2-yl-bis[(2-methylpropan-2-yl)oxy]silane is sourced from PubChem (CID 173186996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).