(4R)-4-methyl-4-triethylsilyloxyhex-5-enal

C13H26O2Si — CID 25213811

IUPAC(4R)-4-methyl-4-triethylsilyloxyhex-5-enal
SMILESC=C[C@@](C)(CCC=O)O[Si](CC)(CC)CC
InChIInChI=1S/C13H26O2Si/c1-6-13(5,11-10-12-14)15-16(7-2,8-3)9-4/h6,12H,1,7-11H2,2-5H3/t13-/m0/s1
InChIKeyHVHNNZHUZSUGPY-ZDUSSCGKSA-N
MW242.43 g/mol
LogP3.93
Rot. Bonds9

About (4R)-4-methyl-4-triethylsilyloxyhex-5-enal

(4R)-4-methyl-4-triethylsilyloxyhex-5-enal (PubChem CID 25213811) has the molecular formula C13H26O2Si and a molecular weight of 242.43 g/mol. Its IUPAC name is (4R)-4-methyl-4-triethylsilyloxyhex-5-enal.

Molecular Properties

Compound Name(4R)-4-methyl-4-triethylsilyloxyhex-5-enal
PubChem CID25213811
Molecular FormulaC13H26O2Si
Molecular Weight242.43 g/mol
Exact Mass242.17
IUPAC Name(4R)-4-methyl-4-triethylsilyloxyhex-5-enal
SMILESC=C[C@@](C)(CCC=O)O[Si](CC)(CC)CC
InChIInChI=1S/C13H26O2Si/c1-6-13(5,11-10-12-14)15-16(7-2,8-3)9-4/h6,12H,1,7-11H2,2-5H3/t13-/m0/s1
InChIKeyHVHNNZHUZSUGPY-ZDUSSCGKSA-N
XLogP3.93
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.43
LogP ≤ 53.93
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

2-Methyl-2-trimethylsilyloxyhex-5-enal
CID 141587881
4-Methyl-4-triethylsilyloxyhept-6-enal
CID 152417025
(3R,4R)-4-[tert-butyl(dimethyl)silyl]oxy-3-ethenylhex-5-enal
CID 10777366
8-[Tert-butyl(dimethyl)silyl]oxyocta-5,6-dienal
CID 10934060
(4R)-4-[tert-butyl(dimethyl)silyl]oxy-4-methylhex-5-enal
CID 53248197

Frequently Asked Questions

What is the IUPAC name of (4R)-4-methyl-4-triethylsilyloxyhex-5-enal?
The IUPAC name of (4R)-4-methyl-4-triethylsilyloxyhex-5-enal (CID 25213811) is (4R)-4-methyl-4-triethylsilyloxyhex-5-enal.
What is the SMILES notation for (4R)-4-methyl-4-triethylsilyloxyhex-5-enal?
The canonical SMILES for (4R)-4-methyl-4-triethylsilyloxyhex-5-enal is C=C[C@@](C)(CCC=O)O[Si](CC)(CC)CC.
What is the InChIKey of (4R)-4-methyl-4-triethylsilyloxyhex-5-enal?
The InChIKey is HVHNNZHUZSUGPY-ZDUSSCGKSA-N. The full InChI is InChI=1S/C13H26O2Si/c1-6-13(5,11-10-12-14)15-16(7-2,8-3)9-4/h6,12H,1,7-11H2,2-5H3/t13-/m0/s1.
What are the key properties of (4R)-4-methyl-4-triethylsilyloxyhex-5-enal?
(4R)-4-methyl-4-triethylsilyloxyhex-5-enal has a molecular weight of 242.43 g/mol, XLogP of 3.93, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-4-methyl-4-triethylsilyloxyhex-5-enal is sourced from PubChem (CID 25213811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).