hydroxy-tris(2-methylpentan-2-yl)silane

C18H40OSi — CID 87942452

IUPAChydroxy-tris(2-methylpentan-2-yl)silane
SMILESCCCC(C)(C)[Si](O)(C(C)(C)CCC)C(C)(C)CCC
InChIInChI=1S/C18H40OSi/c1-10-13-16(4,5)20(19,17(6,7)14-11-2)18(8,9)15-12-3/h19H,10-15H2,1-9H3
InChIKeyCJPMJFDJTYMFSY-UHFFFAOYSA-N
MW300.60 g/mol
LogP6.67
Rot. Bonds9

About hydroxy-tris(2-methylpentan-2-yl)silane

hydroxy-tris(2-methylpentan-2-yl)silane (PubChem CID 87942452) has the molecular formula C18H40OSi and a molecular weight of 300.60 g/mol. Its IUPAC name is hydroxy-tris(2-methylpentan-2-yl)silane.

Molecular Properties

Compound Namehydroxy-tris(2-methylpentan-2-yl)silane
PubChem CID87942452
Molecular FormulaC18H40OSi
Molecular Weight300.60 g/mol
Exact Mass300.28
IUPAC Namehydroxy-tris(2-methylpentan-2-yl)silane
SMILESCCCC(C)(C)[Si](O)(C(C)(C)CCC)C(C)(C)CCC
InChIInChI=1S/C18H40OSi/c1-10-13-16(4,5)20(19,17(6,7)14-11-2)18(8,9)15-12-3/h19H,10-15H2,1-9H3
InChIKeyCJPMJFDJTYMFSY-UHFFFAOYSA-N
XLogP6.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500300.60
LogP ≤ 56.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Analyze hydroxy-tris(2-methylpentan-2-yl)silane 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 hydroxy-tris(2-methylpentan-2-yl)silane?
The IUPAC name of hydroxy-tris(2-methylpentan-2-yl)silane (CID 87942452) is hydroxy-tris(2-methylpentan-2-yl)silane.
What is the SMILES notation for hydroxy-tris(2-methylpentan-2-yl)silane?
The canonical SMILES for hydroxy-tris(2-methylpentan-2-yl)silane is CCCC(C)(C)[Si](O)(C(C)(C)CCC)C(C)(C)CCC.
What is the InChIKey of hydroxy-tris(2-methylpentan-2-yl)silane?
The InChIKey is CJPMJFDJTYMFSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40OSi/c1-10-13-16(4,5)20(19,17(6,7)14-11-2)18(8,9)15-12-3/h19H,10-15H2,1-9H3.
What are the key properties of hydroxy-tris(2-methylpentan-2-yl)silane?
hydroxy-tris(2-methylpentan-2-yl)silane has a molecular weight of 300.60 g/mol, XLogP of 6.67, 9 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-tris(2-methylpentan-2-yl)silane is sourced from PubChem (CID 87942452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).