5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal

C15H32O3Si — CID 86640420

IUPAC5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal
SMILESCC(C)(CC=O)CCOCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32O3Si/c1-14(2,3)19(6,7)18-13-12-17-11-9-15(4,5)8-10-16/h10H,8-9,11-13H2,1-7H3
InChIKeyXYXCDXCSGYTYLN-UHFFFAOYSA-N
MW288.50 g/mol
LogP4.03
Rot. Bonds9

About 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal

5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal (PubChem CID 86640420) has the molecular formula C15H32O3Si and a molecular weight of 288.50 g/mol. Its IUPAC name is 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal.

Molecular Properties

Compound Name5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal
PubChem CID86640420
Molecular FormulaC15H32O3Si
Molecular Weight288.50 g/mol
Exact Mass288.21
IUPAC Name5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal
SMILESCC(C)(CC=O)CCOCCO[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32O3Si/c1-14(2,3)19(6,7)18-13-12-17-11-9-15(4,5)8-10-16/h10H,8-9,11-13H2,1-7H3
InChIKeyXYXCDXCSGYTYLN-UHFFFAOYSA-N
XLogP4.03
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.50
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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'}

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Related Compounds

5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentan-1-imine
CID 141301688
tert-butyl-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-dimethylsilane
CID 91694118
2-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]ethoxy-tert-butyl-dimethylsilane
CID 91254063
2-[2-(2-bromoethoxy)ethoxy]ethoxy-tert-butyl-dimethylsilane
CID 18469819
4-[2-[4-[tert-butyl(dimethyl)silyl]oxy-3,3-dimethylbutoxy]ethoxy]-2,2-dimethylbutan-1-ol
CID 10667273
2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]acetic acid
CID 170898180
2-[2-[2-[2-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethyl-trifluoroboranuide
CID 170899743
methyl 2-[[5-[tert-butyl(dimethyl)silyl]oxy-3,3-dimethylpentylidene]amino]acetate
CID 59249428
O-[2-[tert-butyl(dimethyl)silyl]oxyethyl]hydroxylamine
CID 23132349
tert-butyl-[2-[2-[2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-dimethylsilane;2-[2-[2-[2-[2-[2-(2-chloroethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 158402595
7-[tert-butyl(dimethyl)silyl]oxy-5,5-dimethylheptan-2-one
CID 99768812
2-[tert-butyl(dimethyl)silyl]oxy-N-[2-[tert-butyl(dimethyl)silyl]oxyethyl]ethanamine
CID 11427595

Frequently Asked Questions

What is the IUPAC name of 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal?
The IUPAC name of 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal (CID 86640420) is 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal.
What is the SMILES notation for 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal?
The canonical SMILES for 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal is CC(C)(CC=O)CCOCCO[Si](C)(C)C(C)(C)C.
What is the InChIKey of 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal?
The InChIKey is XYXCDXCSGYTYLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O3Si/c1-14(2,3)19(6,7)18-13-12-17-11-9-15(4,5)8-10-16/h10H,8-9,11-13H2,1-7H3.
What are the key properties of 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal?
5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal has a molecular weight of 288.50 g/mol, XLogP of 4.03, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-[tert-butyl(dimethyl)silyl]oxyethoxy]-3,3-dimethylpentanal is sourced from PubChem (CID 86640420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).