trimethyl(4-methylpent-1-ynyl)stannane

C9H18Sn — CID 14546667

IUPACtrimethyl(4-methylpent-1-ynyl)stannane
SMILESCC(C)CC#C[Sn](C)(C)C
InChIInChI=1S/C6H9.3CH3.Sn/c1-4-5-6(2)3;;;;/h6H,5H2,2-3H3;3*1H3;
InChIKeyDQUAQAWYFHTNHL-UHFFFAOYSA-N
MW244.95 g/mol
LogP2.91
Rot. Bonds1

About trimethyl(4-methylpent-1-ynyl)stannane

trimethyl(4-methylpent-1-ynyl)stannane (PubChem CID 14546667) has the molecular formula C9H18Sn and a molecular weight of 244.95 g/mol. Its IUPAC name is trimethyl(4-methylpent-1-ynyl)stannane.

Molecular Properties

Compound Nametrimethyl(4-methylpent-1-ynyl)stannane
PubChem CID14546667
Molecular FormulaC9H18Sn
Molecular Weight244.95 g/mol
Exact Mass246.04
IUPAC Nametrimethyl(4-methylpent-1-ynyl)stannane
SMILESCC(C)CC#C[Sn](C)(C)C
InChIInChI=1S/C6H9.3CH3.Sn/c1-4-5-6(2)3;;;;/h6H,5H2,2-3H3;3*1H3;
InChIKeyDQUAQAWYFHTNHL-UHFFFAOYSA-N
XLogP2.91
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.95
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl(4-methylpent-1-ynyl)stannane?
The IUPAC name of trimethyl(4-methylpent-1-ynyl)stannane (CID 14546667) is trimethyl(4-methylpent-1-ynyl)stannane.
What is the SMILES notation for trimethyl(4-methylpent-1-ynyl)stannane?
The canonical SMILES for trimethyl(4-methylpent-1-ynyl)stannane is CC(C)CC#C[Sn](C)(C)C.
What is the InChIKey of trimethyl(4-methylpent-1-ynyl)stannane?
The InChIKey is DQUAQAWYFHTNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9.3CH3.Sn/c1-4-5-6(2)3;;;;/h6H,5H2,2-3H3;3*1H3;.
What are the key properties of trimethyl(4-methylpent-1-ynyl)stannane?
trimethyl(4-methylpent-1-ynyl)stannane has a molecular weight of 244.95 g/mol, XLogP of 2.91, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(4-methylpent-1-ynyl)stannane is sourced from PubChem (CID 14546667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).