(4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal

C16H30O2Si — CID 156679736

IUPAC(4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal
SMILESCC/C=C\C/C=C\CC(C=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30O2Si/c1-7-8-9-10-11-12-13-15(14-17)18-19(5,6)16(2,3)4/h8-9,11-12,14-15H,7,10,13H2,1-6H3/b9-8-,12-11-
InChIKeyWKRCGDUYHQDLOR-MURFETPASA-N
MW282.50 g/mol
LogP4.88
Rot. Bonds8

About (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal

(4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal (PubChem CID 156679736) has the molecular formula C16H30O2Si and a molecular weight of 282.50 g/mol. Its IUPAC name is (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal.

Molecular Properties

Compound Name(4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal
PubChem CID156679736
Molecular FormulaC16H30O2Si
Molecular Weight282.50 g/mol
Exact Mass282.20
IUPAC Name(4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal
SMILESCC/C=C\C/C=C\CC(C=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C16H30O2Si/c1-7-8-9-10-11-12-13-15(14-17)18-19(5,6)16(2,3)4/h8-9,11-12,14-15H,7,10,13H2,1-6H3/b9-8-,12-11-
InChIKeyWKRCGDUYHQDLOR-MURFETPASA-N
XLogP4.88
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.50
LogP ≤ 54.88
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'}

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Related Compounds

(2R,3S)-2-[tert-butyl(dimethyl)silyl]oxy-3-methylpent-4-enal
CID 10977251
(Z,3S)-3-[tert-butyl(dimethyl)silyl]oxyoct-5-enal
CID 101902361
(Z,2S)-2-[tert-butyl(dimethyl)silyl]oxydec-4-enal
CID 10636838
(3R,5Z,8Z)-3-[tert-butyl(dimethyl)silyl]oxytetradeca-5,8-dienal
CID 10830885
(Z,2R)-2,6-bis[[tert-butyl(dimethyl)silyl]oxy]hex-4-enal
CID 10904450
(E,2S)-2,6-bis[[tert-butyl(dimethyl)silyl]oxy]hex-4-enal
CID 11961736
(E)-2-[tert-butyl(dimethyl)silyl]oxy-2-methoxyhex-4-enal
CID 13584116
(E,5S)-5-[tert-butyl(dimethyl)silyl]oxy-4-oxohex-2-enal
CID 102368687
5-Methyl-2-(3-methylbut-2-enyl)-2-triethylsilyloxyhex-4-enal
CID 102401914
(e)-8-[t-Butyl(dimethyl)silyloxy]oct-5-enal
CID 132279469
(Z)-2-[tert-butyl(dimethyl)silyl]oxydec-4-enal
CID 134895328
(2S)-2-[tert-butyl(dimethyl)silyl]oxy-4-methyl-2-prop-2-enylpent-3-enal
CID 138969756

Frequently Asked Questions

What is the IUPAC name of (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal?
The IUPAC name of (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal (CID 156679736) is (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal.
What is the SMILES notation for (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal?
The canonical SMILES for (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal is CC/C=C\C/C=C\CC(C=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal?
The InChIKey is WKRCGDUYHQDLOR-MURFETPASA-N. The full InChI is InChI=1S/C16H30O2Si/c1-7-8-9-10-11-12-13-15(14-17)18-19(5,6)16(2,3)4/h8-9,11-12,14-15H,7,10,13H2,1-6H3/b9-8-,12-11-.
What are the key properties of (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal?
(4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal has a molecular weight of 282.50 g/mol, XLogP of 4.88, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4Z,7Z)-2-[tert-butyl(dimethyl)silyl]oxydeca-4,7-dienal is sourced from PubChem (CID 156679736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).