bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane

C16H38O7Si4 — CID 157285943

IUPACbis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane
SMILESCC(C)CC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C.O=C=O.O=C=O
InChIInChI=1S/C14H38O3Si4.2CO2/c1-14(2)12-13-21(11,16-19(6,7)8)17-20(9,10)15-18(3,4)5;2*2-1-3/h14H,12-13H2,1-11H3;;
InChIKeyBAFSILPAVMTENT-UHFFFAOYSA-N
MW454.82 g/mol
LogP4.36
Rot. Bonds9

About bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane

bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane (PubChem CID 157285943) has the molecular formula C16H38O7Si4 and a molecular weight of 454.82 g/mol. Its IUPAC name is bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane.

Molecular Properties

Compound Namebis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane
PubChem CID157285943
Molecular FormulaC16H38O7Si4
Molecular Weight454.82 g/mol
Exact Mass454.17
IUPAC Namebis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane
SMILESCC(C)CC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C.O=C=O.O=C=O
InChIInChI=1S/C14H38O3Si4.2CO2/c1-14(2)12-13-21(11,16-19(6,7)8)17-20(9,10)15-18(3,4)5;2*2-1-3/h14H,12-13H2,1-11H3;;
InChIKeyBAFSILPAVMTENT-UHFFFAOYSA-N
XLogP4.36
TPSA95.97 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.82
LogP ≤ 54.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2,2,4,4,6,6,8,8,10,10,12-Undecamethyl-12-(2-methylbutyl)-1,3,5,7,9,11-hexaoxa-2,4,6,8,10,12-hexasilacyclododecane
CID 20813318
[[[[Bis(2-methylpropyl)-[tris(2-methylpropyl)silyloxy]silyl]oxy-bis(2-methylpropyl)silyl]oxy-bis(2-methylpropyl)silyl]oxy-bis(2-methylpropyl)silyl] acetate
CID 87197815
[[[Bis(2-methylpropyl)-[tris(2-methylpropyl)silyloxy]silyl]oxy-bis(2-methylpropyl)silyl]oxy-bis(2-methylpropyl)silyl] acetate
CID 87197843
[[[[[Bis(2-methylpropyl)-[tris(2-methylpropyl)silyloxy]silyl]oxy-bis(2-methylpropyl)silyl]oxy-bis(2-methylpropyl)silyl]oxy-bis(2-methylpropyl)silyl]oxy-bis(2-methylpropyl)silyl] acetate
CID 87197855
Bis[tri(propan-2-yl)silyl] carbonate
CID 142674597
Bis(carbon dioxide);[dimethyl(3-methylbutyl)silyl]oxy-dimethyl-trimethylsilyloxysilane;methane
CID 157386817
Bis(carbon dioxide);dimethyl-(3-methylbutyl)-trimethylsilyloxysilane;methane
CID 157424463
Dimethoxy-bis(3-methylbutyl)silane;dimethoxy-(2-methylpropyl)-propan-2-ylsilane
CID 157539021
Bis(carbon dioxide);[dimethyl(3-methylbutyl)silyl]oxy-dimethyl-trimethylsilyloxysilane;methane
CID 157723836
Bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane;methane
CID 157872565
Bis(carbon dioxide);[dimethyl(3-methylbutyl)silyl]oxy-dimethyl-trimethylsilyloxysilane;methane
CID 158315848
Bis(carbon dioxide);trimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxysilane
CID 159066575

Frequently Asked Questions

What is the IUPAC name of bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane?
The IUPAC name of bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane (CID 157285943) is bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane.
What is the SMILES notation for bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane?
The canonical SMILES for bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane is CC(C)CC[Si](C)(O[Si](C)(C)C)O[Si](C)(C)O[Si](C)(C)C.O=C=O.O=C=O.
What is the InChIKey of bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane?
The InChIKey is BAFSILPAVMTENT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H38O3Si4.2CO2/c1-14(2)12-13-21(11,16-19(6,7)8)17-20(9,10)15-18(3,4)5;2*2-1-3/h14H,12-13H2,1-11H3;;.
What are the key properties of bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane?
bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane has a molecular weight of 454.82 g/mol, XLogP of 4.36, 9 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for bis(carbon dioxide);dimethyl-[methyl-(3-methylbutyl)-trimethylsilyloxysilyl]oxy-trimethylsilyloxysilane is sourced from PubChem (CID 157285943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).