trimethyl(tridec-12-en-1,7-diynyl)silane

C16H26Si — CID 13273604

IUPACtrimethyl(tridec-12-en-1,7-diynyl)silane
SMILESC=CCCCC#CCCCCC#C[Si](C)(C)C
InChIInChI=1S/C16H26Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)4/h5H,1,6-8,11-14H2,2-4H3
InChIKeyFEHOHZSXTCOBEE-UHFFFAOYSA-N
MW246.47 g/mol
LogP4.79
Rot. Bonds6

About trimethyl(tridec-12-en-1,7-diynyl)silane

trimethyl(tridec-12-en-1,7-diynyl)silane (PubChem CID 13273604) has the molecular formula C16H26Si and a molecular weight of 246.47 g/mol. Its IUPAC name is trimethyl(tridec-12-en-1,7-diynyl)silane.

Molecular Properties

Compound Nametrimethyl(tridec-12-en-1,7-diynyl)silane
PubChem CID13273604
Molecular FormulaC16H26Si
Molecular Weight246.47 g/mol
Exact Mass246.18
IUPAC Nametrimethyl(tridec-12-en-1,7-diynyl)silane
SMILESC=CCCCC#CCCCCC#C[Si](C)(C)C
InChIInChI=1S/C16H26Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)4/h5H,1,6-8,11-14H2,2-4H3
InChIKeyFEHOHZSXTCOBEE-UHFFFAOYSA-N
XLogP4.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.47
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl(tridec-12-en-1,7-diynyl)silane?
The IUPAC name of trimethyl(tridec-12-en-1,7-diynyl)silane (CID 13273604) is trimethyl(tridec-12-en-1,7-diynyl)silane.
What is the SMILES notation for trimethyl(tridec-12-en-1,7-diynyl)silane?
The canonical SMILES for trimethyl(tridec-12-en-1,7-diynyl)silane is C=CCCCC#CCCCCC#C[Si](C)(C)C.
What is the InChIKey of trimethyl(tridec-12-en-1,7-diynyl)silane?
The InChIKey is FEHOHZSXTCOBEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)4/h5H,1,6-8,11-14H2,2-4H3.
What are the key properties of trimethyl(tridec-12-en-1,7-diynyl)silane?
trimethyl(tridec-12-en-1,7-diynyl)silane has a molecular weight of 246.47 g/mol, XLogP of 4.79, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl(tridec-12-en-1,7-diynyl)silane is sourced from PubChem (CID 13273604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).