diethyl-(3-methylbutoxy)-pentadecoxysilane

C24H52O2Si — CID 91744142

IUPACdiethyl-(3-methylbutoxy)-pentadecoxysilane
SMILESCCCCCCCCCCCCCCCO[Si](CC)(CC)OCCC(C)C
InChIInChI=1S/C24H52O2Si/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-22-25-27(7-2,8-3)26-23-21-24(4)5/h24H,6-23H2,1-5H3
InChIKeyRVUOGVKGBVPWCL-UHFFFAOYSA-N
MW400.76 g/mol
LogP8.64
Rot. Bonds21

About diethyl-(3-methylbutoxy)-pentadecoxysilane

diethyl-(3-methylbutoxy)-pentadecoxysilane (PubChem CID 91744142) has the molecular formula C24H52O2Si and a molecular weight of 400.76 g/mol. Its IUPAC name is diethyl-(3-methylbutoxy)-pentadecoxysilane.

Molecular Properties

Compound Namediethyl-(3-methylbutoxy)-pentadecoxysilane
PubChem CID91744142
Molecular FormulaC24H52O2Si
Molecular Weight400.76 g/mol
Exact Mass400.37
IUPAC Namediethyl-(3-methylbutoxy)-pentadecoxysilane
SMILESCCCCCCCCCCCCCCCO[Si](CC)(CC)OCCC(C)C
InChIInChI=1S/C24H52O2Si/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-22-25-27(7-2,8-3)26-23-21-24(4)5/h24H,6-23H2,1-5H3
InChIKeyRVUOGVKGBVPWCL-UHFFFAOYSA-N
XLogP8.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds21
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500400.76
LogP ≤ 58.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

decoxy-diethyl-nonoxysilane
CID 91743782
diethyl-pentadecoxy-tridecoxysilane
CID 91745757
diethyl-pentadecoxy-tetradecoxysilane
CID 91745841
dodecoxy-diethyl-octoxysilane
CID 91744145
diethyl-hexoxy-undecoxysilane
CID 91742902
diethyl-pentoxy-undecoxysilane
CID 91742318
diethyl-nonoxy-pentoxysilane
CID 91741088
diethyl-hexadecoxy-(2-methylpropoxy)silane
CID 91744158
dodecoxy-diethyl-(2-methylpentoxy)silane
CID 91743359
decoxy-diethyl-(2-methylpentoxy)silane
CID 91742310
diethyl-octadecoxy-pentan-2-yloxysilane
CID 91744997
diethyl-hexoxy-(2-methylbutoxy)silane
CID 91738220

Frequently Asked Questions

What is the IUPAC name of diethyl-(3-methylbutoxy)-pentadecoxysilane?
The IUPAC name of diethyl-(3-methylbutoxy)-pentadecoxysilane (CID 91744142) is diethyl-(3-methylbutoxy)-pentadecoxysilane.
What is the SMILES notation for diethyl-(3-methylbutoxy)-pentadecoxysilane?
The canonical SMILES for diethyl-(3-methylbutoxy)-pentadecoxysilane is CCCCCCCCCCCCCCCO[Si](CC)(CC)OCCC(C)C.
What is the InChIKey of diethyl-(3-methylbutoxy)-pentadecoxysilane?
The InChIKey is RVUOGVKGBVPWCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52O2Si/c1-6-9-10-11-12-13-14-15-16-17-18-19-20-22-25-27(7-2,8-3)26-23-21-24(4)5/h24H,6-23H2,1-5H3.
What are the key properties of diethyl-(3-methylbutoxy)-pentadecoxysilane?
diethyl-(3-methylbutoxy)-pentadecoxysilane has a molecular weight of 400.76 g/mol, XLogP of 8.64, 21 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethyl-(3-methylbutoxy)-pentadecoxysilane is sourced from PubChem (CID 91744142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).