6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one

C15H38O4Si4 — CID 59854365

IUPAC6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one
SMILESCC(=O)CCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C15H38O4Si4/c1-15(16)13-11-12-14-23(10,18-21(5,6)7)19-22(8,9)17-20(2,3)4/h11-14H2,1-10H3
InChIKeyKJAVXVKSXWJGHF-UHFFFAOYSA-N
MW394.81 g/mol
LogP5.24
Rot. Bonds11

About 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one

6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one (PubChem CID 59854365) has the molecular formula C15H38O4Si4 and a molecular weight of 394.81 g/mol. Its IUPAC name is 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one.

Molecular Properties

Compound Name6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one
PubChem CID59854365
Molecular FormulaC15H38O4Si4
Molecular Weight394.81 g/mol
Exact Mass394.18
IUPAC Name6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one
SMILESCC(=O)CCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C
InChIInChI=1S/C15H38O4Si4/c1-15(16)13-11-12-14-23(10,18-21(5,6)7)19-22(8,9)17-20(2,3)4/h11-14H2,1-10H3
InChIKeyKJAVXVKSXWJGHF-UHFFFAOYSA-N
XLogP5.24
TPSA44.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500394.81
LogP ≤ 55.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one?
The IUPAC name of 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one (CID 59854365) is 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one.
What is the SMILES notation for 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one?
The canonical SMILES for 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one is CC(=O)CCCC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C.
What is the InChIKey of 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one?
The InChIKey is KJAVXVKSXWJGHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H38O4Si4/c1-15(16)13-11-12-14-23(10,18-21(5,6)7)19-22(8,9)17-20(2,3)4/h11-14H2,1-10H3.
What are the key properties of 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one?
6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one has a molecular weight of 394.81 g/mol, XLogP of 5.24, 11 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[dimethyl(trimethylsilyloxy)silyl]oxy-methyl-trimethylsilyloxysilyl]hexan-2-one is sourced from PubChem (CID 59854365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).