9-[tert-butyl(dimethyl)silyl]oxynonanal

C15H32O2Si — CID 10956668

IUPAC9-[tert-butyl(dimethyl)silyl]oxynonanal
SMILESCC(C)(C)[Si](C)(C)OCCCCCCCCC=O
InChIInChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14-12-10-8-6-7-9-11-13-16/h13H,6-12,14H2,1-5H3
InChIKeyBPRTWDODENWXPE-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.94
Rot. Bonds10

About 9-[tert-butyl(dimethyl)silyl]oxynonanal

9-[tert-butyl(dimethyl)silyl]oxynonanal (PubChem CID 10956668) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is 9-[tert-butyl(dimethyl)silyl]oxynonanal.

Molecular Properties

Compound Name9-[tert-butyl(dimethyl)silyl]oxynonanal
PubChem CID10956668
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name9-[tert-butyl(dimethyl)silyl]oxynonanal
SMILESCC(C)(C)[Si](C)(C)OCCCCCCCCC=O
InChIInChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14-12-10-8-6-7-9-11-13-16/h13H,6-12,14H2,1-5H3
InChIKeyBPRTWDODENWXPE-UHFFFAOYSA-N
XLogP4.94
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.50
LogP ≤ 54.94
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'}

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Frequently Asked Questions

What is the IUPAC name of 9-[tert-butyl(dimethyl)silyl]oxynonanal?
The IUPAC name of 9-[tert-butyl(dimethyl)silyl]oxynonanal (CID 10956668) is 9-[tert-butyl(dimethyl)silyl]oxynonanal.
What is the SMILES notation for 9-[tert-butyl(dimethyl)silyl]oxynonanal?
The canonical SMILES for 9-[tert-butyl(dimethyl)silyl]oxynonanal is CC(C)(C)[Si](C)(C)OCCCCCCCCC=O.
What is the InChIKey of 9-[tert-butyl(dimethyl)silyl]oxynonanal?
The InChIKey is BPRTWDODENWXPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-15(2,3)18(4,5)17-14-12-10-8-6-7-9-11-13-16/h13H,6-12,14H2,1-5H3.
What are the key properties of 9-[tert-butyl(dimethyl)silyl]oxynonanal?
9-[tert-butyl(dimethyl)silyl]oxynonanal has a molecular weight of 272.50 g/mol, XLogP of 4.94, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[tert-butyl(dimethyl)silyl]oxynonanal is sourced from PubChem (CID 10956668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).