6-tri(propan-2-yl)silyloxyhexanal

C15H32O2Si — CID 15438838

IUPAC6-tri(propan-2-yl)silyloxyhexanal
SMILESCC(C)[Si](OCCCCCC=O)(C(C)C)C(C)C
InChIInChI=1S/C15H32O2Si/c1-13(2)18(14(3)4,15(5)6)17-12-10-8-7-9-11-16/h11,13-15H,7-10,12H2,1-6H3
InChIKeyQIMIIUYIGXBXIR-UHFFFAOYSA-N
MW272.50 g/mol
LogP4.94
Rot. Bonds10

About 6-tri(propan-2-yl)silyloxyhexanal

6-tri(propan-2-yl)silyloxyhexanal (PubChem CID 15438838) has the molecular formula C15H32O2Si and a molecular weight of 272.50 g/mol. Its IUPAC name is 6-tri(propan-2-yl)silyloxyhexanal.

Molecular Properties

Compound Name6-tri(propan-2-yl)silyloxyhexanal
PubChem CID15438838
Molecular FormulaC15H32O2Si
Molecular Weight272.50 g/mol
Exact Mass272.22
IUPAC Name6-tri(propan-2-yl)silyloxyhexanal
SMILESCC(C)[Si](OCCCCCC=O)(C(C)C)C(C)C
InChIInChI=1S/C15H32O2Si/c1-13(2)18(14(3)4,15(5)6)17-12-10-8-7-9-11-16/h11,13-15H,7-10,12H2,1-6H3
InChIKeyQIMIIUYIGXBXIR-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 6-tri(propan-2-yl)silyloxyhexanal?
The IUPAC name of 6-tri(propan-2-yl)silyloxyhexanal (CID 15438838) is 6-tri(propan-2-yl)silyloxyhexanal.
What is the SMILES notation for 6-tri(propan-2-yl)silyloxyhexanal?
The canonical SMILES for 6-tri(propan-2-yl)silyloxyhexanal is CC(C)[Si](OCCCCCC=O)(C(C)C)C(C)C.
What is the InChIKey of 6-tri(propan-2-yl)silyloxyhexanal?
The InChIKey is QIMIIUYIGXBXIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2Si/c1-13(2)18(14(3)4,15(5)6)17-12-10-8-7-9-11-16/h11,13-15H,7-10,12H2,1-6H3.
What are the key properties of 6-tri(propan-2-yl)silyloxyhexanal?
6-tri(propan-2-yl)silyloxyhexanal 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 6-tri(propan-2-yl)silyloxyhexanal is sourced from PubChem (CID 15438838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).