3,3-dimethylbut-1-en-2-ylsilane

C6H14Si — CID 173032105

IUPAC3,3-dimethylbut-1-en-2-ylsilane
SMILESC=C([SiH3])C(C)(C)C
InChIInChI=1S/C6H14Si/c1-5(7)6(2,3)4/h1H2,2-4,7H3
InChIKeyDJMCJNDHTJJSIE-UHFFFAOYSA-N
MW114.26 g/mol
LogP0.91
Rot. Bonds

About 3,3-dimethylbut-1-en-2-ylsilane

3,3-dimethylbut-1-en-2-ylsilane (PubChem CID 173032105) has the molecular formula C6H14Si and a molecular weight of 114.26 g/mol. Its IUPAC name is 3,3-dimethylbut-1-en-2-ylsilane.

Molecular Properties

Compound Name3,3-dimethylbut-1-en-2-ylsilane
PubChem CID173032105
Molecular FormulaC6H14Si
Molecular Weight114.26 g/mol
Exact Mass114.09
IUPAC Name3,3-dimethylbut-1-en-2-ylsilane
SMILESC=C([SiH3])C(C)(C)C
InChIInChI=1S/C6H14Si/c1-5(7)6(2,3)4/h1H2,2-4,7H3
InChIKeyDJMCJNDHTJJSIE-UHFFFAOYSA-N
XLogP0.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.26
LogP ≤ 50.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 3,3-dimethylbut-1-en-2-ylsilane?
The IUPAC name of 3,3-dimethylbut-1-en-2-ylsilane (CID 173032105) is 3,3-dimethylbut-1-en-2-ylsilane.
What is the SMILES notation for 3,3-dimethylbut-1-en-2-ylsilane?
The canonical SMILES for 3,3-dimethylbut-1-en-2-ylsilane is C=C([SiH3])C(C)(C)C.
What is the InChIKey of 3,3-dimethylbut-1-en-2-ylsilane?
The InChIKey is DJMCJNDHTJJSIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14Si/c1-5(7)6(2,3)4/h1H2,2-4,7H3.
What are the key properties of 3,3-dimethylbut-1-en-2-ylsilane?
3,3-dimethylbut-1-en-2-ylsilane has a molecular weight of 114.26 g/mol, XLogP of 0.91, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-dimethylbut-1-en-2-ylsilane is sourced from PubChem (CID 173032105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).