trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane

C18H26Si — CID 15373352

IUPACtrimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane
SMILESC[Si](C)(C)C/C=C/CCCCC#Cc1ccccc1
InChIInChI=1S/C18H26Si/c1-19(2,3)17-13-8-6-4-5-7-10-14-18-15-11-9-12-16-18/h8-9,11-13,15-16H,4-7,17H2,1-3H3/b13-8+
InChIKeyDUIFSOLRLXVUPU-MDWZMJQESA-N
MW270.49 g/mol
LogP5.49
Rot. Bonds6

About trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane

trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane (PubChem CID 15373352) has the molecular formula C18H26Si and a molecular weight of 270.49 g/mol. Its IUPAC name is trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane
PubChem CID15373352
Molecular FormulaC18H26Si
Molecular Weight270.49 g/mol
Exact Mass270.18
IUPAC Nametrimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane
SMILESC[Si](C)(C)C/C=C/CCCCC#Cc1ccccc1
InChIInChI=1S/C18H26Si/c1-19(2,3)17-13-8-6-4-5-7-10-14-18-15-11-9-12-16-18/h8-9,11-13,15-16H,4-7,17H2,1-3H3/b13-8+
InChIKeyDUIFSOLRLXVUPU-MDWZMJQESA-N
XLogP5.49
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500270.49
LogP ≤ 55.49
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-[(E)-9-phenylnon-2-en-8-ynyl]silane?
The IUPAC name of trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane (CID 15373352) is trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane.
What is the SMILES notation for trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane?
The canonical SMILES for trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane is C[Si](C)(C)C/C=C/CCCCC#Cc1ccccc1.
What is the InChIKey of trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane?
The InChIKey is DUIFSOLRLXVUPU-MDWZMJQESA-N. The full InChI is InChI=1S/C18H26Si/c1-19(2,3)17-13-8-6-4-5-7-10-14-18-15-11-9-12-16-18/h8-9,11-13,15-16H,4-7,17H2,1-3H3/b13-8+.
What are the key properties of trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane?
trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane has a molecular weight of 270.49 g/mol, XLogP of 5.49, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(E)-9-phenylnon-2-en-8-ynyl]silane is sourced from PubChem (CID 15373352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).