[(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane

C15H22OSi — CID 134993692

IUPAC[(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane
SMILESCCOC(=C\[Si](C)(C)C)/C=C/c1ccccc1
InChIInChI=1S/C15H22OSi/c1-5-16-15(13-17(2,3)4)12-11-14-9-7-6-8-10-14/h6-13H,5H2,1-4H3/b12-11+,15-13-
InChIKeyDLLHJDHGTSZVPQ-UDPMFAINSA-N
MW246.43 g/mol
LogP4.50
Rot. Bonds5

About [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane

[(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane (PubChem CID 134993692) has the molecular formula C15H22OSi and a molecular weight of 246.43 g/mol. Its IUPAC name is [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane.

Molecular Properties

Compound Name[(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane
PubChem CID134993692
Molecular FormulaC15H22OSi
Molecular Weight246.43 g/mol
Exact Mass246.14
IUPAC Name[(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane
SMILESCCOC(=C\[Si](C)(C)C)/C=C/c1ccccc1
InChIInChI=1S/C15H22OSi/c1-5-16-15(13-17(2,3)4)12-11-14-9-7-6-8-10-14/h6-13H,5H2,1-4H3/b12-11+,15-13-
InChIKeyDLLHJDHGTSZVPQ-UDPMFAINSA-N
XLogP4.50
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.43
LogP ≤ 54.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'}

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Related Compounds

[(1E,3E)-2-ethyl-4-phenylbuta-1,3-dienyl]-trimethylsilane
CID 10036853
diethyl 2-(3-phenylprop-2-enoylamino)propanedioate
CID 141472099
[(E)-1-ethoxy-3-phenylprop-2-enylidene]manganese
CID 11121228
ethyl (E,2S)-2-hydroxy-4-oxo-6-phenylhex-5-enoate
CID 56851553
trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane
CID 134982365
ethyl carbamate;(E)-3-phenylprop-2-enoic acid
CID 70467325
ethyl acetate;(Z)-3-phenylprop-2-enoic acid
CID 174849368
ethyl (2Z,4E)-2-fluoro-3-methyl-5-phenylpenta-2,4-dienoate
CID 84820398
carbon monoxide;(3E)-2-ethoxy-4-phenylbuta-1,3-dien-1-one;iron
CID 10892788
ethyl 2-methylidene-4-phenylbut-3-enoate
CID 54282000
ethyl acetate;ethyl (E)-3-phenylprop-2-enoate
CID 163289975
[(E)-3-phenylprop-2-enoyl]carbamic acid
CID 140993183

Frequently Asked Questions

What is the IUPAC name of [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane?
The IUPAC name of [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane (CID 134993692) is [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane.
What is the SMILES notation for [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane?
The canonical SMILES for [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane is CCOC(=C\[Si](C)(C)C)/C=C/c1ccccc1.
What is the InChIKey of [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane?
The InChIKey is DLLHJDHGTSZVPQ-UDPMFAINSA-N. The full InChI is InChI=1S/C15H22OSi/c1-5-16-15(13-17(2,3)4)12-11-14-9-7-6-8-10-14/h6-13H,5H2,1-4H3/b12-11+,15-13-.
What are the key properties of [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane?
[(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane has a molecular weight of 246.43 g/mol, XLogP of 4.50, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane is sourced from PubChem (CID 134993692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).