tributyl(trihydroxysilylperoxy)silane

C12H30O5Si2 — CID 140667716

IUPACtributyl(trihydroxysilylperoxy)silane
SMILESCCCC[Si](CCCC)(CCCC)OO[Si](O)(O)O
InChIInChI=1S/C12H30O5Si2/c1-4-7-10-18(11-8-5-2,12-9-6-3)16-17-19(13,14)15/h13-15H,4-12H2,1-3H3
InChIKeyPXXDNTGGRWFWDU-UHFFFAOYSA-N
MW310.54 g/mol
LogP2.69
Rot. Bonds12

About tributyl(trihydroxysilylperoxy)silane

tributyl(trihydroxysilylperoxy)silane (PubChem CID 140667716) has the molecular formula C12H30O5Si2 and a molecular weight of 310.54 g/mol. Its IUPAC name is tributyl(trihydroxysilylperoxy)silane.

Molecular Properties

Compound Nametributyl(trihydroxysilylperoxy)silane
PubChem CID140667716
Molecular FormulaC12H30O5Si2
Molecular Weight310.54 g/mol
Exact Mass310.16
IUPAC Nametributyl(trihydroxysilylperoxy)silane
SMILESCCCC[Si](CCCC)(CCCC)OO[Si](O)(O)O
InChIInChI=1S/C12H30O5Si2/c1-4-7-10-18(11-8-5-2,12-9-6-3)16-17-19(13,14)15/h13-15H,4-12H2,1-3H3
InChIKeyPXXDNTGGRWFWDU-UHFFFAOYSA-N
XLogP2.69
TPSA79.15 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.54
LogP ≤ 52.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

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Related Compounds

tetrakis(tributylsilyl) silicate
CID 163284439
tributyl(germyloxy)silane
CID 159018718
trihydroxy-[octadecyl-bis(trihydroxysilyloxy)silyl]oxysilane
CID 101049224
butoxy(tributyl)silane
CID 594608
butyl-methoxy-dipropylsilane
CID 22228688
[3-[acetyloxy(dibutyl)silyl]propyl-dibutylsilyl] acetate
CID 87144314
tributylsilyl hydrogen sulfate
CID 18317151
dibutyl-[3-[dibutyl(propoxy)silyl]propyl]-propoxysilane
CID 87145187
heptane;trihydroxy(methoxy)silane
CID 174556151
tributylsilyl butanoate
CID 615215
butoxy-dibutyl-ethylsilane
CID 141095554
tributyl(decoxy)silane
CID 523467

Frequently Asked Questions

What is the IUPAC name of tributyl(trihydroxysilylperoxy)silane?
The IUPAC name of tributyl(trihydroxysilylperoxy)silane (CID 140667716) is tributyl(trihydroxysilylperoxy)silane.
What is the SMILES notation for tributyl(trihydroxysilylperoxy)silane?
The canonical SMILES for tributyl(trihydroxysilylperoxy)silane is CCCC[Si](CCCC)(CCCC)OO[Si](O)(O)O.
What is the InChIKey of tributyl(trihydroxysilylperoxy)silane?
The InChIKey is PXXDNTGGRWFWDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H30O5Si2/c1-4-7-10-18(11-8-5-2,12-9-6-3)16-17-19(13,14)15/h13-15H,4-12H2,1-3H3.
What are the key properties of tributyl(trihydroxysilylperoxy)silane?
tributyl(trihydroxysilylperoxy)silane has a molecular weight of 310.54 g/mol, XLogP of 2.69, 12 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for tributyl(trihydroxysilylperoxy)silane is sourced from PubChem (CID 140667716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).