bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane

C42H88O10Si — CID 101356644

IUPACbis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane
SMILESCCCCCCCCCCCCOCCOCCOCCOCCO[Si](C)(C)OCCOCCOCCOCCOCCCCCCCCCCCC
InChIInChI=1S/C42H88O10Si/c1-5-7-9-11-13-15-17-19-21-23-25-43-27-29-45-31-33-47-35-37-49-39-41-51-53(3,4)52-42-40-50-38-36-48-34-32-46-30-28-44-26-24-22-20-18-16-14-12-10-8-6-2/h5-42H2,1-4H3
InChIKeyCCHHAKXPRWDZHU-UHFFFAOYSA-N
MW781.24 g/mol
LogP9.70
Rot. Bonds48

About bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane

bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane (PubChem CID 101356644) has the molecular formula C42H88O10Si and a molecular weight of 781.24 g/mol. Its IUPAC name is bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane.

Molecular Properties

Compound Namebis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane
PubChem CID101356644
Molecular FormulaC42H88O10Si
Molecular Weight781.24 g/mol
Exact Mass780.61
IUPAC Namebis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane
SMILESCCCCCCCCCCCCOCCOCCOCCOCCO[Si](C)(C)OCCOCCOCCOCCOCCCCCCCCCCCC
InChIInChI=1S/C42H88O10Si/c1-5-7-9-11-13-15-17-19-21-23-25-43-27-29-45-31-33-47-35-37-49-39-41-51-53(3,4)52-42-40-50-38-36-48-34-32-46-30-28-44-26-24-22-20-18-16-14-12-10-8-6-2/h5-42H2,1-4H3
InChIKeyCCHHAKXPRWDZHU-UHFFFAOYSA-N
XLogP9.70
TPSA92.30 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds48
Heavy Atoms53
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500781.24
LogP ≤ 59.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Related Compounds

2-butoxyethoxy-dimethyl-(2-propoxyethoxy)silane
CID 91522026
2-[2-(2-decoxyethoxy)ethoxy]ethoxy-trimethylsilane
CID 526726
hexoxy-dimethyl-nonoxysilane
CID 91741085
hexoxy-dimethyl-undecoxysilane
CID 91742305
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hexadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octadecane
CID 86345710
1-(2-octoxyethoxy)octane
CID 12711862
1-[2-[2-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]octane
CID 151767279
1-[2-[2-[2-[2-(2-pentoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]heptane
CID 150797704
1-[2-(2-tetradecoxyethoxy)ethoxy]tetradecane
CID 10743953
1-[2-(2-heptoxyethoxy)ethoxy]heptane
CID 14402381
1-[2-[2-[2-(2-hexoxyethoxy)ethoxy]ethoxy]ethoxy]octane
CID 86197097
1-(2-decoxyethoxy)decane
CID 14009354

Frequently Asked Questions

What is the IUPAC name of bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane?
The IUPAC name of bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane (CID 101356644) is bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane.
What is the SMILES notation for bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane?
The canonical SMILES for bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane is CCCCCCCCCCCCOCCOCCOCCOCCO[Si](C)(C)OCCOCCOCCOCCOCCCCCCCCCCCC.
What is the InChIKey of bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane?
The InChIKey is CCHHAKXPRWDZHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C42H88O10Si/c1-5-7-9-11-13-15-17-19-21-23-25-43-27-29-45-31-33-47-35-37-49-39-41-51-53(3,4)52-42-40-50-38-36-48-34-32-46-30-28-44-26-24-22-20-18-16-14-12-10-8-6-2/h5-42H2,1-4H3.
What are the key properties of bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane?
bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane has a molecular weight of 781.24 g/mol, XLogP of 9.70, 48 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for bis[2-[2-[2-(2-dodecoxyethoxy)ethoxy]ethoxy]ethoxy]-dimethylsilane is sourced from PubChem (CID 101356644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).