trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane

C12H26OSi2 — CID 10332004

IUPACtrimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane
SMILESC[Si](C)(C)/C=C/C(CC1CO1)[Si](C)(C)C
InChIInChI=1S/C12H26OSi2/c1-14(2,3)8-7-12(15(4,5)6)9-11-10-13-11/h7-8,11-12H,9-10H2,1-6H3/b8-7+
InChIKeyCGQICJVYQFENIV-BQYQJAHWSA-N
MW242.51 g/mol
LogP3.92
Rot. Bonds5

About trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane

trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane (PubChem CID 10332004) has the molecular formula C12H26OSi2 and a molecular weight of 242.51 g/mol. Its IUPAC name is trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane
PubChem CID10332004
Molecular FormulaC12H26OSi2
Molecular Weight242.51 g/mol
Exact Mass242.15
IUPAC Nametrimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane
SMILESC[Si](C)(C)/C=C/C(CC1CO1)[Si](C)(C)C
InChIInChI=1S/C12H26OSi2/c1-14(2,3)8-7-12(15(4,5)6)9-11-10-13-11/h7-8,11-12H,9-10H2,1-6H3/b8-7+
InChIKeyCGQICJVYQFENIV-BQYQJAHWSA-N
XLogP3.92
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.51
LogP ≤ 53.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane?
The IUPAC name of trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane (CID 10332004) is trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane.
What is the SMILES notation for trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane?
The canonical SMILES for trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane is C[Si](C)(C)/C=C/C(CC1CO1)[Si](C)(C)C.
What is the InChIKey of trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane?
The InChIKey is CGQICJVYQFENIV-BQYQJAHWSA-N. The full InChI is InChI=1S/C12H26OSi2/c1-14(2,3)8-7-12(15(4,5)6)9-11-10-13-11/h7-8,11-12H,9-10H2,1-6H3/b8-7+.
What are the key properties of trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane?
trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane has a molecular weight of 242.51 g/mol, XLogP of 3.92, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-1-(oxiran-2-yl)-4-trimethylsilylbut-3-en-2-yl]silane is sourced from PubChem (CID 10332004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).