trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane

C13H16Si — CID 101156945

IUPACtrimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane
SMILESC[Si](C)(C)/C=C\C#Cc1ccccc1
InChIInChI=1S/C13H16Si/c1-14(2,3)12-8-7-11-13-9-5-4-6-10-13/h4-6,8-10,12H,1-3H3/b12-8-
InChIKeyCPHKGGDEWFTXHI-WQLSENKSSA-N
MW200.36 g/mol
LogP3.47
Rot. Bonds1

About trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane

trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane (PubChem CID 101156945) has the molecular formula C13H16Si and a molecular weight of 200.36 g/mol. Its IUPAC name is trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane.

Molecular Properties

Compound Nametrimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane
PubChem CID101156945
Molecular FormulaC13H16Si
Molecular Weight200.36 g/mol
Exact Mass200.10
IUPAC Nametrimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane
SMILESC[Si](C)(C)/C=C\C#Cc1ccccc1
InChIInChI=1S/C13H16Si/c1-14(2,3)12-8-7-11-13-9-5-4-6-10-13/h4-6,8-10,12H,1-3H3/b12-8-
InChIKeyCPHKGGDEWFTXHI-WQLSENKSSA-N
XLogP3.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.36
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane?
The IUPAC name of trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane (CID 101156945) is trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane.
What is the SMILES notation for trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane?
The canonical SMILES for trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane is C[Si](C)(C)/C=C\C#Cc1ccccc1.
What is the InChIKey of trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane?
The InChIKey is CPHKGGDEWFTXHI-WQLSENKSSA-N. The full InChI is InChI=1S/C13H16Si/c1-14(2,3)12-8-7-11-13-9-5-4-6-10-13/h4-6,8-10,12H,1-3H3/b12-8-.
What are the key properties of trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane?
trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane has a molecular weight of 200.36 g/mol, XLogP of 3.47, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(Z)-4-phenylbut-1-en-3-ynyl]silane is sourced from PubChem (CID 101156945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).