trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane

C15H24OSi — CID 13004934

IUPACtrimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane
SMILESCC(C)=C(Cc1ccc(C)cc1)O[Si](C)(C)C
InChIInChI=1S/C15H24OSi/c1-12(2)15(16-17(4,5)6)11-14-9-7-13(3)8-10-14/h7-10H,11H2,1-6H3
InChIKeyVORDKEHQNNRQAM-UHFFFAOYSA-N
MW248.44 g/mol
LogP4.68
Rot. Bonds4

About trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane

trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane (PubChem CID 13004934) has the molecular formula C15H24OSi and a molecular weight of 248.44 g/mol. Its IUPAC name is trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane
PubChem CID13004934
Molecular FormulaC15H24OSi
Molecular Weight248.44 g/mol
Exact Mass248.16
IUPAC Nametrimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane
SMILESCC(C)=C(Cc1ccc(C)cc1)O[Si](C)(C)C
InChIInChI=1S/C15H24OSi/c1-12(2)15(16-17(4,5)6)11-14-9-7-13(3)8-10-14/h7-10H,11H2,1-6H3
InChIKeyVORDKEHQNNRQAM-UHFFFAOYSA-N
XLogP4.68
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.44
LogP ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane?
The IUPAC name of trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane (CID 13004934) is trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane.
What is the SMILES notation for trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane?
The canonical SMILES for trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane is CC(C)=C(Cc1ccc(C)cc1)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane?
The InChIKey is VORDKEHQNNRQAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24OSi/c1-12(2)15(16-17(4,5)6)11-14-9-7-13(3)8-10-14/h7-10H,11H2,1-6H3.
What are the key properties of trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane?
trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane has a molecular weight of 248.44 g/mol, XLogP of 4.68, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[3-methyl-1-(4-methylphenyl)but-2-en-2-yl]oxysilane is sourced from PubChem (CID 13004934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).