trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane

C11H24SSi — CID 135038504

IUPACtrimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane
SMILESCC=C(C)C(C)SCC[Si](C)(C)C
InChIInChI=1S/C11H24SSi/c1-7-10(2)11(3)12-8-9-13(4,5)6/h7,11H,8-9H2,1-6H3
InChIKeyDHEFFPOSHLSKHA-UHFFFAOYSA-N
MW216.47 g/mol
LogP4.41
Rot. Bonds5

About trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane

trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane (PubChem CID 135038504) has the molecular formula C11H24SSi and a molecular weight of 216.47 g/mol. Its IUPAC name is trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane.

Molecular Properties

Compound Nametrimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane
PubChem CID135038504
Molecular FormulaC11H24SSi
Molecular Weight216.47 g/mol
Exact Mass216.14
IUPAC Nametrimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane
SMILESCC=C(C)C(C)SCC[Si](C)(C)C
InChIInChI=1S/C11H24SSi/c1-7-10(2)11(3)12-8-9-13(4,5)6/h7,11H,8-9H2,1-6H3
InChIKeyDHEFFPOSHLSKHA-UHFFFAOYSA-N
XLogP4.41
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.47
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane?
The IUPAC name of trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane (CID 135038504) is trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane.
What is the SMILES notation for trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane?
The canonical SMILES for trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane is CC=C(C)C(C)SCC[Si](C)(C)C.
What is the InChIKey of trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane?
The InChIKey is DHEFFPOSHLSKHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24SSi/c1-7-10(2)11(3)12-8-9-13(4,5)6/h7,11H,8-9H2,1-6H3.
What are the key properties of trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane?
trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane has a molecular weight of 216.47 g/mol, XLogP of 4.41, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[2-(3-methylpent-3-en-2-ylsulfanyl)ethyl]silane is sourced from PubChem (CID 135038504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).