(E,2R)-2-triethylsilyloxydec-4-enal

C16H32O2Si — CID 100980663

IUPAC(E,2R)-2-triethylsilyloxydec-4-enal
SMILESCCCCC/C=C/C[C@H](C=O)O[Si](CC)(CC)CC
InChIInChI=1S/C16H32O2Si/c1-5-9-10-11-12-13-14-16(15-17)18-19(6-2,7-3)8-4/h12-13,15-16H,5-11,14H2,1-4H3/b13-12+/t16-/m1/s1
InChIKeyWTEFDQICODANKP-CJTWTEFWSA-N
MW284.52 g/mol
LogP5.10
Rot. Bonds12

About (E,2R)-2-triethylsilyloxydec-4-enal

(E,2R)-2-triethylsilyloxydec-4-enal (PubChem CID 100980663) has the molecular formula C16H32O2Si and a molecular weight of 284.52 g/mol. Its IUPAC name is (E,2R)-2-triethylsilyloxydec-4-enal.

Molecular Properties

Compound Name(E,2R)-2-triethylsilyloxydec-4-enal
PubChem CID100980663
Molecular FormulaC16H32O2Si
Molecular Weight284.52 g/mol
Exact Mass284.22
IUPAC Name(E,2R)-2-triethylsilyloxydec-4-enal
SMILESCCCCC/C=C/C[C@H](C=O)O[Si](CC)(CC)CC
InChIInChI=1S/C16H32O2Si/c1-5-9-10-11-12-13-14-16(15-17)18-19(6-2,7-3)8-4/h12-13,15-16H,5-11,14H2,1-4H3/b13-12+/t16-/m1/s1
InChIKeyWTEFDQICODANKP-CJTWTEFWSA-N
XLogP5.10
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds12
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

(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
(Z)-4-[tert-butyl(dimethyl)silyl]oxydodec-6-enal
CID 14409373
5-Methyl-2-(3-methylbut-2-enyl)-2-triethylsilyloxyhex-4-enal
CID 102401914
(6S)-2,9-dimethyl-6-triethylsilyloxydeca-2,8-dien-5-one
CID 102401926
(Z)-2-[tert-butyl(dimethyl)silyl]oxydec-4-enal
CID 134895328
(6S)-6-[tert-butyl(dimethyl)silyl]oxycyclohex-3-en-1-one
CID 155933052
(E,2S)-2-[tert-butyl(dimethyl)silyl]oxy-5-tributylstannylhex-4-enal
CID 155934417
(S,Z)-3-((tert-butyl)dimethylsiloxy)-6-methylnona-5,8-dien-2-one
CID 45258940
(2R)-2-[tert-butyl(dimethyl)silyl]oxydec-4-enal
CID 54381278

Frequently Asked Questions

What is the IUPAC name of (E,2R)-2-triethylsilyloxydec-4-enal?
The IUPAC name of (E,2R)-2-triethylsilyloxydec-4-enal (CID 100980663) is (E,2R)-2-triethylsilyloxydec-4-enal.
What is the SMILES notation for (E,2R)-2-triethylsilyloxydec-4-enal?
The canonical SMILES for (E,2R)-2-triethylsilyloxydec-4-enal is CCCCC/C=C/C[C@H](C=O)O[Si](CC)(CC)CC.
What is the InChIKey of (E,2R)-2-triethylsilyloxydec-4-enal?
The InChIKey is WTEFDQICODANKP-CJTWTEFWSA-N. The full InChI is InChI=1S/C16H32O2Si/c1-5-9-10-11-12-13-14-16(15-17)18-19(6-2,7-3)8-4/h12-13,15-16H,5-11,14H2,1-4H3/b13-12+/t16-/m1/s1.
What are the key properties of (E,2R)-2-triethylsilyloxydec-4-enal?
(E,2R)-2-triethylsilyloxydec-4-enal has a molecular weight of 284.52 g/mol, XLogP of 5.10, 12 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E,2R)-2-triethylsilyloxydec-4-enal is sourced from PubChem (CID 100980663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).