(Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal

C16H28O2Si — CID 132503854

IUPAC(Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal
SMILESC#CCC(/C=C(/C)CCC=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H28O2Si/c1-8-10-15(13-14(2)11-9-12-17)18-19(6,7)16(3,4)5/h1,12-13,15H,9-11H2,2-7H3/b14-13-
InChIKeyZPMGVIMCHRVRJG-YPKPFQOOSA-N
MW280.48 g/mol
LogP4.33
Rot. Bonds7

About (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal

(Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal (PubChem CID 132503854) has the molecular formula C16H28O2Si and a molecular weight of 280.48 g/mol. Its IUPAC name is (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal.

Molecular Properties

Compound Name(Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal
PubChem CID132503854
Molecular FormulaC16H28O2Si
Molecular Weight280.48 g/mol
Exact Mass280.19
IUPAC Name(Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal
SMILESC#CCC(/C=C(/C)CCC=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H28O2Si/c1-8-10-15(13-14(2)11-9-12-17)18-19(6,7)16(3,4)5/h1,12-13,15H,9-11H2,2-7H3/b14-13-
InChIKeyZPMGVIMCHRVRJG-YPKPFQOOSA-N
XLogP4.33
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.48
LogP ≤ 54.33
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': 'triple_bond', 'substructure': 'N/A'}

Analyze (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal 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

3-[tert-butyl(dimethyl)silyl]oxy-5,9,13-trimethyltetradeca-4,8,12-trien-1-ol
CID 54333928
(3R)-3-[tert-butyl(dimethyl)silyl]oxyhex-5-ynal
CID 11218406
(4S,5R)-5-[tert-butyl(dimethyl)silyl]oxy-4-[(1R)-1-[tert-butyl(dimethyl)silyl]oxyprop-2-enyl]oct-7-ynal
CID 10895167
4,6-dimethyloct-4-enal
CID 71411187
tert-butyl-dimethyl-pent-4-yn-2-yloxysilane
CID 588048
methyl (4S,7E,9E,11R)-4,11-bis[[tert-butyl(dimethyl)silyl]oxy]tetradeca-7,9-dien-5,13-diynoate
CID 71665234
tert-butyl-dimethyl-[(6E)-3,7,11-trimethyldodeca-6,10-dien-1-yn-3-yl]oxysilane
CID 101181765
2-[tert-butyl(dimethyl)silyl]oxy-5-trimethylsilylpent-4-ynal
CID 58461604
methyl (2R,3R)-3-[tert-butyl(dimethyl)silyl]oxy-2-prop-2-enylhex-5-ynoate
CID 50915307
[(2E,6E)-1-[tert-butyl(dimethyl)silyl]oxy-8-chloro-3,7-dimethylocta-2,6-dienyl] acetate
CID 132535606
tert-butyl-dimethyl-(6-methylidenedec-1-en-9-yn-3-yloxy)silane
CID 139252745
tert-butyl (3R)-3-[tert-butyl(dimethyl)silyl]oxy-4-oxobutanoate
CID 10565326

Frequently Asked Questions

What is the IUPAC name of (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal?
The IUPAC name of (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal (CID 132503854) is (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal.
What is the SMILES notation for (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal?
The canonical SMILES for (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal is C#CCC(/C=C(/C)CCC=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal?
The InChIKey is ZPMGVIMCHRVRJG-YPKPFQOOSA-N. The full InChI is InChI=1S/C16H28O2Si/c1-8-10-15(13-14(2)11-9-12-17)18-19(6,7)16(3,4)5/h1,12-13,15H,9-11H2,2-7H3/b14-13-.
What are the key properties of (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal?
(Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal has a molecular weight of 280.48 g/mol, XLogP of 4.33, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-6-[tert-butyl(dimethyl)silyl]oxy-4-methylnon-4-en-8-ynal is sourced from PubChem (CID 132503854), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).