trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane

C21H54O5Si5 — CID 552764

IUPACtrimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane
SMILESC[Si](C)(C)OCCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C21H54O5Si5/c1-27(2,3)22-17-16-19(24-29(7,8)9)21(26-31(13,14)15)20(25-30(10,11)12)18-23-28(4,5)6/h19-21H,16-18H2,1-15H3
InChIKeyULCPMKYKEVLMSQ-UHFFFAOYSA-N
MW527.09 g/mol
LogP6.74
Rot. Bonds15

About trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane

trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane (PubChem CID 552764) has the molecular formula C21H54O5Si5 and a molecular weight of 527.09 g/mol. Its IUPAC name is trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane.

Molecular Properties

Compound Nametrimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane
PubChem CID552764
Molecular FormulaC21H54O5Si5
Molecular Weight527.09 g/mol
Exact Mass526.28
IUPAC Nametrimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane
SMILESC[Si](C)(C)OCCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO[Si](C)(C)C)O[Si](C)(C)C
InChIInChI=1S/C21H54O5Si5/c1-27(2,3)22-17-16-19(24-29(7,8)9)21(26-31(13,14)15)20(25-30(10,11)12)18-23-28(4,5)6/h19-21H,16-18H2,1-15H3
InChIKeyULCPMKYKEVLMSQ-UHFFFAOYSA-N
XLogP6.74
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds15
Heavy Atoms31
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500527.09
LogP ≤ 56.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Trimethylsilyl-meso-inositol
CID 520232
L-Sorbitol TMS
CID 518921
D-Erythro-Pentitol, 2-deoxy-1,3,4,5-tetrakis-O-(trimethylsilyl)-
CID 552765
1,2,3,4,5,6-Hexakis-O-(trimethylsilyl)-D-glucitol
CID 13829212
D-Mannitol, TMS
CID 13829214
Trimethylsilyldulcitol
CID 13829215
Ribitol, 1,2,3,4,5-pentakis-O-(trimethylsilyl)-
CID 14534972
Arabitol, pentakis(trimethylsilyl)-
CID 91746473
Trimethylsilyl ether of xylitol
CID 518901
L-Fucitol TMS
CID 529419
1,5-Anhydroglucitol, TMS
CID 529471
d-Glucitol, 1,2,3,4,5,6-hexakis-O-(trimethylsilyl)-
CID 91746474

Frequently Asked Questions

What is the IUPAC name of trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane?
The IUPAC name of trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane (CID 552764) is trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane.
What is the SMILES notation for trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane?
The canonical SMILES for trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane is C[Si](C)(C)OCCC(O[Si](C)(C)C)C(O[Si](C)(C)C)C(CO[Si](C)(C)C)O[Si](C)(C)C.
What is the InChIKey of trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane?
The InChIKey is ULCPMKYKEVLMSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H54O5Si5/c1-27(2,3)22-17-16-19(24-29(7,8)9)21(26-31(13,14)15)20(25-30(10,11)12)18-23-28(4,5)6/h19-21H,16-18H2,1-15H3.
What are the key properties of trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane?
trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane has a molecular weight of 527.09 g/mol, XLogP of 6.74, 15 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[1,3,4,6-tetrakis(trimethylsilyloxy)hexan-2-yloxy]silane is sourced from PubChem (CID 552764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).