(E)-6-triphenylsilylhex-4-en-3-one

C24H24OSi — CID 11199087

IUPAC(E)-6-triphenylsilylhex-4-en-3-one
SMILESCCC(=O)/C=C/C[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H24OSi/c1-2-21(25)13-12-20-26(22-14-6-3-7-15-22,23-16-8-4-9-17-23)24-18-10-5-11-19-24/h3-19H,2,20H2,1H3/b13-12+
InChIKeyIDENGOCHOXVYCP-OUKQBFOZSA-N
MW356.54 g/mol
LogP3.69
Rot. Bonds7

About (E)-6-triphenylsilylhex-4-en-3-one

(E)-6-triphenylsilylhex-4-en-3-one (PubChem CID 11199087) has the molecular formula C24H24OSi and a molecular weight of 356.54 g/mol. Its IUPAC name is (E)-6-triphenylsilylhex-4-en-3-one.

Molecular Properties

Compound Name(E)-6-triphenylsilylhex-4-en-3-one
PubChem CID11199087
Molecular FormulaC24H24OSi
Molecular Weight356.54 g/mol
Exact Mass356.16
IUPAC Name(E)-6-triphenylsilylhex-4-en-3-one
SMILESCCC(=O)/C=C/C[Si](c1ccccc1)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H24OSi/c1-2-21(25)13-12-20-26(22-14-6-3-7-15-22,23-16-8-4-9-17-23)24-18-10-5-11-19-24/h3-19H,2,20H2,1H3/b13-12+
InChIKeyIDENGOCHOXVYCP-OUKQBFOZSA-N
XLogP3.69
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.54
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

Acetyltriphenylsilane
CID 5226386
(E)-1-[dimethyl(phenyl)silyl]-3-methylpent-3-en-2-one
CID 24867780
2-Fluoro-1-triphenylsilylethanone
CID 86003433
(E)-1-triphenylgermylbut-2-en-1-one
CID 11646445
3,4-Bis[dimethyl(phenyl)silyl]cyclobut-3-ene-1,2-dione
CID 11792193
(1E)-4-[[dimethyl(phenyl)silyl]methyl]-1-phenylpenta-1,4-dien-3-one
CID 12046570
(E)-3-iodo-1-triphenylsilylprop-2-en-1-one
CID 14934032
(E)-3-tributylstannyl-1-triphenylsilylprop-2-en-1-one
CID 14934034
(2E)-1-triphenylsilylpenta-2,4-dien-1-one
CID 14934037
3-Methyl-1-triphenylsilylbut-2-en-1-one
CID 14976916
Triphenylsilyl vinyl ketone
CID 15033005
(E)-1-triphenylsilylhept-2-en-1-one
CID 15033619

Frequently Asked Questions

What is the IUPAC name of (E)-6-triphenylsilylhex-4-en-3-one?
The IUPAC name of (E)-6-triphenylsilylhex-4-en-3-one (CID 11199087) is (E)-6-triphenylsilylhex-4-en-3-one.
What is the SMILES notation for (E)-6-triphenylsilylhex-4-en-3-one?
The canonical SMILES for (E)-6-triphenylsilylhex-4-en-3-one is CCC(=O)/C=C/C[Si](c1ccccc1)(c1ccccc1)c1ccccc1.
What is the InChIKey of (E)-6-triphenylsilylhex-4-en-3-one?
The InChIKey is IDENGOCHOXVYCP-OUKQBFOZSA-N. The full InChI is InChI=1S/C24H24OSi/c1-2-21(25)13-12-20-26(22-14-6-3-7-15-22,23-16-8-4-9-17-23)24-18-10-5-11-19-24/h3-19H,2,20H2,1H3/b13-12+.
What are the key properties of (E)-6-triphenylsilylhex-4-en-3-one?
(E)-6-triphenylsilylhex-4-en-3-one has a molecular weight of 356.54 g/mol, XLogP of 3.69, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-6-triphenylsilylhex-4-en-3-one is sourced from PubChem (CID 11199087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).