2-(2-oxoethenyl)-2-silylpent-4-enal

C7H10O2Si — CID 173386650

IUPAC2-(2-oxoethenyl)-2-silylpent-4-enal
SMILESC=CCC([SiH3])(C=O)C=C=O
InChIInChI=1S/C7H10O2Si/c1-2-3-7(10,6-9)4-5-8/h2,4,6H,1,3H2,10H3
InChIKeyHDVGXGJMKMHKTA-UHFFFAOYSA-N
MW154.24 g/mol
LogP-0.33
Rot. Bonds4

About 2-(2-oxoethenyl)-2-silylpent-4-enal

2-(2-oxoethenyl)-2-silylpent-4-enal (PubChem CID 173386650) has the molecular formula C7H10O2Si and a molecular weight of 154.24 g/mol. Its IUPAC name is 2-(2-oxoethenyl)-2-silylpent-4-enal.

Molecular Properties

Compound Name2-(2-oxoethenyl)-2-silylpent-4-enal
PubChem CID173386650
Molecular FormulaC7H10O2Si
Molecular Weight154.24 g/mol
Exact Mass154.05
IUPAC Name2-(2-oxoethenyl)-2-silylpent-4-enal
SMILESC=CCC([SiH3])(C=O)C=C=O
InChIInChI=1S/C7H10O2Si/c1-2-3-7(10,6-9)4-5-8/h2,4,6H,1,3H2,10H3
InChIKeyHDVGXGJMKMHKTA-UHFFFAOYSA-N
XLogP-0.33
TPSA34.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.24
LogP ≤ 5-0.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'ketene', 'substructure': 'N/A'}

Analyze 2-(2-oxoethenyl)-2-silylpent-4-enal with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-bromo-2-prop-2-enylpent-4-enal
CID 174833072
2-ethenyl-2-hydroxypent-4-enal
CID 173106151
but-3-ene-1,1,1-tricarboxylic acid
CID 59237686
ethenylsilane;isocyanic acid
CID 172759413
isocyanic acid;3-prop-2-enoxyprop-1-ene
CID 88728289
4,4-dimethylhepta-2,6-dienal
CID 173202566
3-hydroxy-3-methyl-7-methylidenenona-1,8-dien-1-one
CID 140611138
(2R)-2-(4-bromophenyl)-2-ethylpent-4-enal
CID 138970188
hepta-1,6-diene-4,4-diamine
CID 21275124
lithium prop-2-enyl sulfate
CID 87403119
1,4-bis(4-prop-2-enylhepta-1,6-dien-4-yl)benzene
CID 12066232
(2S)-2-methyl-2-phenylpent-4-enal
CID 10866831

Frequently Asked Questions

What is the IUPAC name of 2-(2-oxoethenyl)-2-silylpent-4-enal?
The IUPAC name of 2-(2-oxoethenyl)-2-silylpent-4-enal (CID 173386650) is 2-(2-oxoethenyl)-2-silylpent-4-enal.
What is the SMILES notation for 2-(2-oxoethenyl)-2-silylpent-4-enal?
The canonical SMILES for 2-(2-oxoethenyl)-2-silylpent-4-enal is C=CCC([SiH3])(C=O)C=C=O.
What is the InChIKey of 2-(2-oxoethenyl)-2-silylpent-4-enal?
The InChIKey is HDVGXGJMKMHKTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10O2Si/c1-2-3-7(10,6-9)4-5-8/h2,4,6H,1,3H2,10H3.
What are the key properties of 2-(2-oxoethenyl)-2-silylpent-4-enal?
2-(2-oxoethenyl)-2-silylpent-4-enal has a molecular weight of 154.24 g/mol, XLogP of -0.33, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-oxoethenyl)-2-silylpent-4-enal is sourced from PubChem (CID 173386650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).