trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane

C17H26OSi — CID 134982365

IUPACtrimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane
SMILESCCCC/C=C(/C=C/c1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C17H26OSi/c1-5-6-8-13-17(18-19(2,3)4)15-14-16-11-9-7-10-12-16/h7,9-15H,5-6,8H2,1-4H3/b15-14+,17-13-
InChIKeyKVHQAODOBLNDQA-NWDJVLATSA-N
MW274.48 g/mol
LogP5.63
Rot. Bonds7

About trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane

trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane (PubChem CID 134982365) has the molecular formula C17H26OSi and a molecular weight of 274.48 g/mol. Its IUPAC name is trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane.

Molecular Properties

Compound Nametrimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane
PubChem CID134982365
Molecular FormulaC17H26OSi
Molecular Weight274.48 g/mol
Exact Mass274.18
IUPAC Nametrimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane
SMILESCCCC/C=C(/C=C/c1ccccc1)O[Si](C)(C)C
InChIInChI=1S/C17H26OSi/c1-5-6-8-13-17(18-19(2,3)4)15-14-16-11-9-7-10-12-16/h7,9-15H,5-6,8H2,1-4H3/b15-14+,17-13-
InChIKeyKVHQAODOBLNDQA-NWDJVLATSA-N
XLogP5.63
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500274.48
LogP ≤ 55.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

[(1E,3E)-3-bromonona-1,3-dienyl]benzene
CID 135039609
trimethyl-[(1E,3Z)-1-phenyldeca-1,3-dien-3-yl]silane
CID 11437654
[(1Z,3E)-2-ethoxy-4-phenylbuta-1,3-dienyl]-trimethylsilane
CID 134993692
trimethylsilyl (E)-3-phenylprop-2-eneperoxoate
CID 22561457
(E)-3-[(E)-2-phenylethenyl]dec-3-en-1-ol
CID 14452107
pentanoic acid;3-phenylprop-2-enoic acid
CID 130331806
4-(3-butoxy-4-phenylbuta-1,3-dienyl)phenol
CID 87393025
[(1E,3E)-2-ethyl-4-phenylbuta-1,3-dienyl]-trimethylsilane
CID 10036853
[(3Z)-octa-1,3-dienyl]benzene
CID 154692518
(E,4S)-4-hydroxy-1-phenyloct-1-en-3-one
CID 100976642
methyl 2-(3-phenylprop-2-enoylamino)hexanoate
CID 78410683
ethanol;3-phenylprop-2-enoic acid
CID 158830805

Frequently Asked Questions

What is the IUPAC name of trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane?
The IUPAC name of trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane (CID 134982365) is trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane.
What is the SMILES notation for trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane?
The canonical SMILES for trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane is CCCC/C=C(/C=C/c1ccccc1)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane?
The InChIKey is KVHQAODOBLNDQA-NWDJVLATSA-N. The full InChI is InChI=1S/C17H26OSi/c1-5-6-8-13-17(18-19(2,3)4)15-14-16-11-9-7-10-12-16/h7,9-15H,5-6,8H2,1-4H3/b15-14+,17-13-.
What are the key properties of trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane?
trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane has a molecular weight of 274.48 g/mol, XLogP of 5.63, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[(1E,3Z)-1-phenylocta-1,3-dien-3-yl]oxysilane is sourced from PubChem (CID 134982365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).