2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane

C10H26O6Si3 — CID 174544172

IUPAC2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane
SMILESCCCC[Si]1(OCC)O[SiH](OCC)O[SiH](OCC)O1
InChIInChI=1S/C10H26O6Si3/c1-5-9-10-19(13-8-4)15-17(11-6-2)14-18(16-19)12-7-3/h17-18H,5-10H2,1-4H3
InChIKeyYUAKIHHAQVMRDX-UHFFFAOYSA-N
MW326.57 g/mol
LogP1.33
Rot. Bonds9

About 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane

2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane (PubChem CID 174544172) has the molecular formula C10H26O6Si3 and a molecular weight of 326.57 g/mol. Its IUPAC name is 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane.

Molecular Properties

Compound Name2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane
PubChem CID174544172
Molecular FormulaC10H26O6Si3
Molecular Weight326.57 g/mol
Exact Mass326.10
IUPAC Name2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane
SMILESCCCC[Si]1(OCC)O[SiH](OCC)O[SiH](OCC)O1
InChIInChI=1S/C10H26O6Si3/c1-5-9-10-19(13-8-4)15-17(11-6-2)14-18(16-19)12-7-3/h17-18H,5-10H2,1-4H3
InChIKeyYUAKIHHAQVMRDX-UHFFFAOYSA-N
XLogP1.33
TPSA55.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds9
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.57
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2,4,6,8-tetraethoxy-2-propyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 175254771
2,6-diethoxy-2,4,8,10-tetramethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
CID 169041077
3-(2-ethoxy-4-methoxy-4,6,6,8,8-pentamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocan-2-yl)propan-1-amine
CID 167539584
3-(2-ethoxy-1,3,2-dioxasilinan-2-yl)propane-1-thiol
CID 151968282
1,1,2,2,3,3,4,4,5,5-decabutylpentasilolane
CID 12561632
2-butyl-2,4,4,6,6,8,8-heptamethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane;2-butyl-2,4,4,6,6,8,8,10,10-nonamethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane;2-butyl-2,4,4,6,6-pentamethyl-1,3,5,2,4,6-trioxatrisilinane
CID 158551467
2,5-diethoxy-2,5-dimethyl-1,4,2,5-dioxadisilinane
CID 90308478
CID 139212281
CID 139212281
2,4,6,8,10-pentamethyl-2-octadecyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
CID 123929311
2,4,6,8-tetramethyl-2,4,6,8-tetrapentyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
CID 142697059
3,3,6,6-tetraethoxy-1,2,4,5,3,6-tetraoxadisilinane
CID 11066533
decane;ruthenium
CID 160818595

Frequently Asked Questions

What is the IUPAC name of 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane?
The IUPAC name of 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane (CID 174544172) is 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane.
What is the SMILES notation for 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane?
The canonical SMILES for 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane is CCCC[Si]1(OCC)O[SiH](OCC)O[SiH](OCC)O1.
What is the InChIKey of 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane?
The InChIKey is YUAKIHHAQVMRDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H26O6Si3/c1-5-9-10-19(13-8-4)15-17(11-6-2)14-18(16-19)12-7-3/h17-18H,5-10H2,1-4H3.
What are the key properties of 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane?
2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane has a molecular weight of 326.57 g/mol, XLogP of 1.33, 9 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butyl-2,4,6-triethoxy-1,3,5,2,4,6-trioxatrisilinane is sourced from PubChem (CID 174544172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).