8-[tert-butyl(dimethyl)silyl]oxydec-9-enal

C16H32O2Si — CID 10589156

IUPAC8-[tert-butyl(dimethyl)silyl]oxydec-9-enal
SMILESC=CC(CCCCCCC=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O2Si/c1-7-15(13-11-9-8-10-12-14-17)18-19(5,6)16(2,3)4/h7,14-15H,1,8-13H2,2-6H3
InChIKeyRXKMDUNHXAUXLQ-UHFFFAOYSA-N
MW284.52 g/mol
LogP5.10
Rot. Bonds10

About 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal

8-[tert-butyl(dimethyl)silyl]oxydec-9-enal (PubChem CID 10589156) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal.

Molecular Properties

Compound Name8-[tert-butyl(dimethyl)silyl]oxydec-9-enal
PubChem CID10589156
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name8-[tert-butyl(dimethyl)silyl]oxydec-9-enal
SMILESC=CC(CCCCCCC=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H32O2Si/c1-7-15(13-11-9-8-10-12-14-17)18-19(5,6)16(2,3)4/h7,14-15H,1,8-13H2,2-6H3
InChIKeyRXKMDUNHXAUXLQ-UHFFFAOYSA-N
XLogP5.10
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.52
LogP ≤ 55.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

(4R,7S)-7-(Triisopropylsiloxy)-4,5-tetradecadien-1-al
CID 11068952
(5R)-5-[tert-butyl(dimethyl)silyl]oxydec-9-en-3-one
CID 134966731
10-[Tert-butyl(dimethyl)silyl]oxyundec-1-en-6-one
CID 11324012
(E)-12-[tert-butyl(dimethyl)silyl]oxyoctadec-4-enal
CID 10453377
(11Z,14Z)-3-((tert-butyldimethylsilyl)oxy)icosa-11,14-dienal
CID 86678085
(12Z,15Z)-4-[tert-butyl(dimethyl)silyl]oxyhenicosa-12,15-dien-2-one
CID 89431987
3-[Tert-butyl(dimethyl)silyl]oxyicosa-11,14-dienal
CID 123840886
(19Z,22R)-22-{[tert-butyl(dimethyl)silyl]oxy}octacos-19-en-11-one
CID 131749544
(E)-6-[diethyl(prop-2-enyl)silyl]oxy-9-hydroxynon-8-enal
CID 140328615
8-Methyl-9-oxo-7-trimethylsilyloxynon-8-enal
CID 140333717
9-Oxo-7-trimethylsilyloxynon-8-enal
CID 140333761
8-(Oxomethylidene)-7-trimethylsilyloxydecanal
CID 140333767

Frequently Asked Questions

What is the IUPAC name of 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal?
The IUPAC name of 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal (CID 10589156) is 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal.
What is the SMILES notation for 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal?
The canonical SMILES for 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal is C=CC(CCCCCCC=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal?
The InChIKey is RXKMDUNHXAUXLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-7-15(13-11-9-8-10-12-14-17)18-19(5,6)16(2,3)4/h7,14-15H,1,8-13H2,2-6H3.
What are the key properties of 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal?
8-[tert-butyl(dimethyl)silyl]oxydec-9-enal has a molecular weight of 284.52 g/mol, XLogP of 5.10, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[tert-butyl(dimethyl)silyl]oxydec-9-enal is sourced from PubChem (CID 10589156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).