8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol

C24H36O2Si — CID 11222865

IUPAC8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol
SMILESCC(C)(C)[Si](OCCCCCCCCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H36O2Si/c1-24(2,3)27(22-16-10-8-11-17-22,23-18-12-9-13-19-23)26-21-15-7-5-4-6-14-20-25/h8-13,16-19,25H,4-7,14-15,20-21H2,1-3H3
InChIKeyJVJBVHWHHVPFAS-UHFFFAOYSA-N
MW384.64 g/mol
LogP4.90
Rot. Bonds11

About 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol

8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol (PubChem CID 11222865) has the molecular formula C24H36O2Si and a molecular weight of 384.64 g/mol. Its IUPAC name is 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol.

Molecular Properties

Compound Name8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol
PubChem CID11222865
Molecular FormulaC24H36O2Si
Molecular Weight384.64 g/mol
Exact Mass384.25
IUPAC Name8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol
SMILESCC(C)(C)[Si](OCCCCCCCCO)(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H36O2Si/c1-24(2,3)27(22-16-10-8-11-17-22,23-18-12-9-13-19-23)26-21-15-7-5-4-6-14-20-25/h8-13,16-19,25H,4-7,14-15,20-21H2,1-3H3
InChIKeyJVJBVHWHHVPFAS-UHFFFAOYSA-N
XLogP4.90
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.64
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'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 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol?
The IUPAC name of 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol (CID 11222865) is 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol.
What is the SMILES notation for 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol?
The canonical SMILES for 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol is CC(C)(C)[Si](OCCCCCCCCO)(c1ccccc1)c1ccccc1.
What is the InChIKey of 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol?
The InChIKey is JVJBVHWHHVPFAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36O2Si/c1-24(2,3)27(22-16-10-8-11-17-22,23-18-12-9-13-19-23)26-21-15-7-5-4-6-14-20-25/h8-13,16-19,25H,4-7,14-15,20-21H2,1-3H3.
What are the key properties of 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol?
8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol has a molecular weight of 384.64 g/mol, XLogP of 4.90, 11 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[tert-butyl(diphenyl)silyl]oxyoctan-1-ol is sourced from PubChem (CID 11222865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).