tris(5,5-dimethylhexyl)-hydroxysilane

C24H52OSi — CID 15936213

IUPACtris(5,5-dimethylhexyl)-hydroxysilane
SMILESCC(C)(C)CCCC[Si](O)(CCCCC(C)(C)C)CCCCC(C)(C)C
InChIInChI=1S/C24H52OSi/c1-22(2,3)16-10-13-19-26(25,20-14-11-17-23(4,5)6)21-15-12-18-24(7,8)9/h25H,10-21H2,1-9H3
InChIKeyVRVCCLATBDIPLK-UHFFFAOYSA-N
MW384.77 g/mol
LogP8.57
Rot. Bonds12

About tris(5,5-dimethylhexyl)-hydroxysilane

tris(5,5-dimethylhexyl)-hydroxysilane (PubChem CID 15936213) has the molecular formula C24H52OSi and a molecular weight of 384.77 g/mol. Its IUPAC name is tris(5,5-dimethylhexyl)-hydroxysilane.

Molecular Properties

Compound Nametris(5,5-dimethylhexyl)-hydroxysilane
PubChem CID15936213
Molecular FormulaC24H52OSi
Molecular Weight384.77 g/mol
Exact Mass384.38
IUPAC Nametris(5,5-dimethylhexyl)-hydroxysilane
SMILESCC(C)(C)CCCC[Si](O)(CCCCC(C)(C)C)CCCCC(C)(C)C
InChIInChI=1S/C24H52OSi/c1-22(2,3)16-10-13-19-26(25,20-14-11-17-23(4,5)6)21-15-12-18-24(7,8)9/h25H,10-21H2,1-9H3
InChIKeyVRVCCLATBDIPLK-UHFFFAOYSA-N
XLogP8.57
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds12
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500384.77
LogP ≤ 58.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 tris(5,5-dimethylhexyl)-hydroxysilane?
The IUPAC name of tris(5,5-dimethylhexyl)-hydroxysilane (CID 15936213) is tris(5,5-dimethylhexyl)-hydroxysilane.
What is the SMILES notation for tris(5,5-dimethylhexyl)-hydroxysilane?
The canonical SMILES for tris(5,5-dimethylhexyl)-hydroxysilane is CC(C)(C)CCCC[Si](O)(CCCCC(C)(C)C)CCCCC(C)(C)C.
What is the InChIKey of tris(5,5-dimethylhexyl)-hydroxysilane?
The InChIKey is VRVCCLATBDIPLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52OSi/c1-22(2,3)16-10-13-19-26(25,20-14-11-17-23(4,5)6)21-15-12-18-24(7,8)9/h25H,10-21H2,1-9H3.
What are the key properties of tris(5,5-dimethylhexyl)-hydroxysilane?
tris(5,5-dimethylhexyl)-hydroxysilane has a molecular weight of 384.77 g/mol, XLogP of 8.57, 12 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for tris(5,5-dimethylhexyl)-hydroxysilane is sourced from PubChem (CID 15936213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).