(3-but-2-enylcycloheptyl)-trimethylsilane

C14H28Si — CID 173273197

IUPAC(3-but-2-enylcycloheptyl)-trimethylsilane
SMILESCC=CCC1CCCCC([Si](C)(C)C)C1
InChIInChI=1S/C14H28Si/c1-5-6-9-13-10-7-8-11-14(12-13)15(2,3)4/h5-6,13-14H,7-12H2,1-4H3
InChIKeyHPNAWFRQTRAVLE-UHFFFAOYSA-N
MW224.46 g/mol
LogP5.24
Rot. Bonds3

About (3-but-2-enylcycloheptyl)-trimethylsilane

(3-but-2-enylcycloheptyl)-trimethylsilane (PubChem CID 173273197) has the molecular formula C14H28Si and a molecular weight of 224.46 g/mol. Its IUPAC name is (3-but-2-enylcycloheptyl)-trimethylsilane.

Molecular Properties

Compound Name(3-but-2-enylcycloheptyl)-trimethylsilane
PubChem CID173273197
Molecular FormulaC14H28Si
Molecular Weight224.46 g/mol
Exact Mass224.20
IUPAC Name(3-but-2-enylcycloheptyl)-trimethylsilane
SMILESCC=CCC1CCCCC([Si](C)(C)C)C1
InChIInChI=1S/C14H28Si/c1-5-6-9-13-10-7-8-11-14(12-13)15(2,3)4/h5-6,13-14H,7-12H2,1-4H3
InChIKeyHPNAWFRQTRAVLE-UHFFFAOYSA-N
XLogP5.24
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500224.46
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 (3-but-2-enylcycloheptyl)-trimethylsilane?
The IUPAC name of (3-but-2-enylcycloheptyl)-trimethylsilane (CID 173273197) is (3-but-2-enylcycloheptyl)-trimethylsilane.
What is the SMILES notation for (3-but-2-enylcycloheptyl)-trimethylsilane?
The canonical SMILES for (3-but-2-enylcycloheptyl)-trimethylsilane is CC=CCC1CCCCC([Si](C)(C)C)C1.
What is the InChIKey of (3-but-2-enylcycloheptyl)-trimethylsilane?
The InChIKey is HPNAWFRQTRAVLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28Si/c1-5-6-9-13-10-7-8-11-14(12-13)15(2,3)4/h5-6,13-14H,7-12H2,1-4H3.
What are the key properties of (3-but-2-enylcycloheptyl)-trimethylsilane?
(3-but-2-enylcycloheptyl)-trimethylsilane has a molecular weight of 224.46 g/mol, XLogP of 5.24, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (3-but-2-enylcycloheptyl)-trimethylsilane is sourced from PubChem (CID 173273197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).