dodecoxy-diethyl-(2-methylpentoxy)silane

C22H48O2Si — CID 91743359

IUPACdodecoxy-diethyl-(2-methylpentoxy)silane
SMILESCCCCCCCCCCCCO[Si](CC)(CC)OCC(C)CCC
InChIInChI=1S/C22H48O2Si/c1-6-10-11-12-13-14-15-16-17-18-20-23-25(8-3,9-4)24-21-22(5)19-7-2/h22H,6-21H2,1-5H3
InChIKeyZUPVIPOGFCDUEO-UHFFFAOYSA-N
MW372.71 g/mol
LogP7.86
Rot. Bonds19

About dodecoxy-diethyl-(2-methylpentoxy)silane

dodecoxy-diethyl-(2-methylpentoxy)silane (PubChem CID 91743359) has the molecular formula C22H48O2Si and a molecular weight of 372.71 g/mol. Its IUPAC name is dodecoxy-diethyl-(2-methylpentoxy)silane.

Molecular Properties

Compound Namedodecoxy-diethyl-(2-methylpentoxy)silane
PubChem CID91743359
Molecular FormulaC22H48O2Si
Molecular Weight372.71 g/mol
Exact Mass372.34
IUPAC Namedodecoxy-diethyl-(2-methylpentoxy)silane
SMILESCCCCCCCCCCCCO[Si](CC)(CC)OCC(C)CCC
InChIInChI=1S/C22H48O2Si/c1-6-10-11-12-13-14-15-16-17-18-20-23-25(8-3,9-4)24-21-22(5)19-7-2/h22H,6-21H2,1-5H3
InChIKeyZUPVIPOGFCDUEO-UHFFFAOYSA-N
XLogP7.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds19
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500372.71
LogP ≤ 57.86
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-(2-methylpentoxy)silane
CID 91742310
diethyl-hexoxy-(2-methylbutoxy)silane
CID 91738220
diethyl-hexadecoxy-(2-methylpropoxy)silane
CID 91744158
diethyl-hexoxy-undecoxysilane
CID 91742902
diethyl-nonoxy-pentoxysilane
CID 91741088
diethyl-pentadecoxy-tetradecoxysilane
CID 91745841
dodecoxy-diethyl-octoxysilane
CID 91744145
decoxy-diethyl-nonoxysilane
CID 91743782
diethyl-pentadecoxy-tridecoxysilane
CID 91745757
diethyl-pentoxy-undecoxysilane
CID 91742318
diethyl-(3-methylbutoxy)-pentadecoxysilane
CID 91744142
diethyl-octadecoxy-pentan-2-yloxysilane
CID 91744997

Frequently Asked Questions

What is the IUPAC name of dodecoxy-diethyl-(2-methylpentoxy)silane?
The IUPAC name of dodecoxy-diethyl-(2-methylpentoxy)silane (CID 91743359) is dodecoxy-diethyl-(2-methylpentoxy)silane.
What is the SMILES notation for dodecoxy-diethyl-(2-methylpentoxy)silane?
The canonical SMILES for dodecoxy-diethyl-(2-methylpentoxy)silane is CCCCCCCCCCCCO[Si](CC)(CC)OCC(C)CCC.
What is the InChIKey of dodecoxy-diethyl-(2-methylpentoxy)silane?
The InChIKey is ZUPVIPOGFCDUEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H48O2Si/c1-6-10-11-12-13-14-15-16-17-18-20-23-25(8-3,9-4)24-21-22(5)19-7-2/h22H,6-21H2,1-5H3.
What are the key properties of dodecoxy-diethyl-(2-methylpentoxy)silane?
dodecoxy-diethyl-(2-methylpentoxy)silane has a molecular weight of 372.71 g/mol, XLogP of 7.86, 19 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for dodecoxy-diethyl-(2-methylpentoxy)silane is sourced from PubChem (CID 91743359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).