5-[tert-butyl(dimethyl)silyl]oxypentanal

C11H24O2Si — CID 10987703

IUPAC5-[tert-butyl(dimethyl)silyl]oxypentanal
SMILESCC(C)(C)[Si](C)(C)OCCCCC=O
InChIInChI=1S/C11H24O2Si/c1-11(2,3)14(4,5)13-10-8-6-7-9-12/h9H,6-8,10H2,1-5H3
InChIKeyYTNNMAIKEURUTO-UHFFFAOYSA-N
MW216.40 g/mol
LogP3.38
Rot. Bonds6

About 5-[tert-butyl(dimethyl)silyl]oxypentanal

5-[tert-butyl(dimethyl)silyl]oxypentanal (PubChem CID 10987703) has the molecular formula C11H24O2Si and a molecular weight of 216.40 g/mol. Its IUPAC name is 5-[tert-butyl(dimethyl)silyl]oxypentanal.

Molecular Properties

Compound Name5-[tert-butyl(dimethyl)silyl]oxypentanal
PubChem CID10987703
Molecular FormulaC11H24O2Si
Molecular Weight216.40 g/mol
Exact Mass216.15
IUPAC Name5-[tert-butyl(dimethyl)silyl]oxypentanal
SMILESCC(C)(C)[Si](C)(C)OCCCCC=O
InChIInChI=1S/C11H24O2Si/c1-11(2,3)14(4,5)13-10-8-6-7-9-12/h9H,6-8,10H2,1-5H3
InChIKeyYTNNMAIKEURUTO-UHFFFAOYSA-N
XLogP3.38
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.40
LogP ≤ 53.38
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'}

Analyze 5-[tert-butyl(dimethyl)silyl]oxypentanal with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-[tert-butyl(dimethyl)silyl]oxypentanal?
The IUPAC name of 5-[tert-butyl(dimethyl)silyl]oxypentanal (CID 10987703) is 5-[tert-butyl(dimethyl)silyl]oxypentanal.
What is the SMILES notation for 5-[tert-butyl(dimethyl)silyl]oxypentanal?
The canonical SMILES for 5-[tert-butyl(dimethyl)silyl]oxypentanal is CC(C)(C)[Si](C)(C)OCCCCC=O.
What is the InChIKey of 5-[tert-butyl(dimethyl)silyl]oxypentanal?
The InChIKey is YTNNMAIKEURUTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O2Si/c1-11(2,3)14(4,5)13-10-8-6-7-9-12/h9H,6-8,10H2,1-5H3.
What are the key properties of 5-[tert-butyl(dimethyl)silyl]oxypentanal?
5-[tert-butyl(dimethyl)silyl]oxypentanal has a molecular weight of 216.40 g/mol, XLogP of 3.38, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[tert-butyl(dimethyl)silyl]oxypentanal is sourced from PubChem (CID 10987703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).