trimethyl(tridec-12-en-1-ynyl)silane

C16H30Si — CID 156771405

IUPACtrimethyl(tridec-12-en-1-ynyl)silane
SMILESC=CCCCCCCCCCC#C[Si](C)(C)C
InChIInChI=1S/C16H30Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)4/h5H,1,6-14H2,2-4H3
InChIKeyKYNDPJBTTQTGFY-UHFFFAOYSA-N
MW250.50 g/mol
LogP5.56
Rot. Bonds9

About trimethyl(tridec-12-en-1-ynyl)silane

trimethyl(tridec-12-en-1-ynyl)silane (PubChem CID 156771405) has the molecular formula C16H30Si and a molecular weight of 250.50 g/mol. Its IUPAC name is trimethyl(tridec-12-en-1-ynyl)silane.

Molecular Properties

Compound Nametrimethyl(tridec-12-en-1-ynyl)silane
PubChem CID156771405
Molecular FormulaC16H30Si
Molecular Weight250.50 g/mol
Exact Mass250.21
IUPAC Nametrimethyl(tridec-12-en-1-ynyl)silane
SMILESC=CCCCCCCCCCC#C[Si](C)(C)C
InChIInChI=1S/C16H30Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)4/h5H,1,6-14H2,2-4H3
InChIKeyKYNDPJBTTQTGFY-UHFFFAOYSA-N
XLogP5.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500250.50
LogP ≤ 55.56
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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Related Compounds

Silane, trimethyl-7-octen-1-ynyl-
CID 10107901
[(Z)-dodec-1-enyl]-trimethylsilane
CID 12476354
Triethyl(hept-6-en-1-yn-1-yl)silane
CID 112756414
[(Z)-dec-1-enyl]-fluoro-dimethylsilane
CID 11148648
Trimethyl(tridec-12-ene-1,7-diyn-1-yl)silane
CID 13273604
Trimethyl(tetradec-13-ene-1,7-diyn-1-yl)silane
CID 13273617
Triisopropyl(3-methylenenon-1-yn-1-yl)silane
CID 102088940
Hept-6-en-1-ynyl(trimethyl)silane
CID 10678786
[(Z)-dodec-1-enyl]-triethylsilane
CID 11033344
[(E)-dodec-1-enyl]-trimethylsilane
CID 11368463
Dec-1-en-3-yl(trimethyl)silane
CID 11413214
[(E)-dodec-1-enyl]-triethylsilane
CID 12996058

Frequently Asked Questions

What is the IUPAC name of trimethyl(tridec-12-en-1-ynyl)silane?
The IUPAC name of trimethyl(tridec-12-en-1-ynyl)silane (CID 156771405) is trimethyl(tridec-12-en-1-ynyl)silane.
What is the SMILES notation for trimethyl(tridec-12-en-1-ynyl)silane?
The canonical SMILES for trimethyl(tridec-12-en-1-ynyl)silane is C=CCCCCCCCCCC#C[Si](C)(C)C.
What is the InChIKey of trimethyl(tridec-12-en-1-ynyl)silane?
The InChIKey is KYNDPJBTTQTGFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30Si/c1-5-6-7-8-9-10-11-12-13-14-15-16-17(2,3)4/h5H,1,6-14H2,2-4H3.
What are the key properties of trimethyl(tridec-12-en-1-ynyl)silane?
trimethyl(tridec-12-en-1-ynyl)silane has a molecular weight of 250.50 g/mol, XLogP of 5.56, 9 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-ynyl)silane is sourced from PubChem (CID 156771405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).