decoxy-diethyl-(6-ethyloctan-3-yloxy)silane

C24H52O2Si — CID 91744124

IUPACdecoxy-diethyl-(6-ethyloctan-3-yloxy)silane
SMILESCCCCCCCCCCO[Si](CC)(CC)OC(CC)CCC(CC)CC
InChIInChI=1S/C24H52O2Si/c1-7-13-14-15-16-17-18-19-22-25-27(11-5,12-6)26-24(10-4)21-20-23(8-2)9-3/h23-24H,7-22H2,1-6H3
InChIKeyDHTNWMTXAZQQPG-UHFFFAOYSA-N
MW400.76 g/mol
LogP8.64
Rot. Bonds20

About decoxy-diethyl-(6-ethyloctan-3-yloxy)silane

decoxy-diethyl-(6-ethyloctan-3-yloxy)silane (PubChem CID 91744124) has the molecular formula C24H52O2Si and a molecular weight of 400.76 g/mol. Its IUPAC name is decoxy-diethyl-(6-ethyloctan-3-yloxy)silane.

Molecular Properties

Compound Namedecoxy-diethyl-(6-ethyloctan-3-yloxy)silane
PubChem CID91744124
Molecular FormulaC24H52O2Si
Molecular Weight400.76 g/mol
Exact Mass400.37
IUPAC Namedecoxy-diethyl-(6-ethyloctan-3-yloxy)silane
SMILESCCCCCCCCCCO[Si](CC)(CC)OC(CC)CCC(CC)CC
InChIInChI=1S/C24H52O2Si/c1-7-13-14-15-16-17-18-19-22-25-27(11-5,12-6)26-24(10-4)21-20-23(8-2)9-3/h23-24H,7-22H2,1-6H3
InChIKeyDHTNWMTXAZQQPG-UHFFFAOYSA-N
XLogP8.64
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds20
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

Silane, dimethyldi(2-ethylhexyloxy)
CID 85694064
tert-butyl-dimethyl-[(3S)-3-methylundecoxy]silane
CID 11312646
Tert-butyl-(cyclooctylmethoxy)-dimethylsilane
CID 70178639
Octa-decyltrimethoxysilane
CID 129773342
(s)-t-Butyl(dimethyl)[(13-methylheptadecyl)oxy]silane
CID 146679947
Diethoxy-[9-(fluoromethyl)heptadecan-9-yloxy]-octylsilane
CID 87900023
Ethyl-(3-fluoro-2-methyldecan-2-yl)oxy-di(propan-2-yloxy)silane
CID 140230149
8-Fluorooctyl-(2-methylpentadecan-2-yloxy)-di(propan-2-yloxy)silane
CID 153946783
Diethoxy-(10-fluorodecyl)-(6-methylpentadecan-2-yloxy)silane
CID 175547717
Diethoxy-ethyl-(1-fluoro-7-methylicosan-7-yl)oxysilane
CID 175556758
2-decanol, tBDMS
CID 6430226
Silane, methylvinyldi(3,7-dimethyloctyloxy)-
CID 91698190

Frequently Asked Questions

What is the IUPAC name of decoxy-diethyl-(6-ethyloctan-3-yloxy)silane?
The IUPAC name of decoxy-diethyl-(6-ethyloctan-3-yloxy)silane (CID 91744124) is decoxy-diethyl-(6-ethyloctan-3-yloxy)silane.
What is the SMILES notation for decoxy-diethyl-(6-ethyloctan-3-yloxy)silane?
The canonical SMILES for decoxy-diethyl-(6-ethyloctan-3-yloxy)silane is CCCCCCCCCCO[Si](CC)(CC)OC(CC)CCC(CC)CC.
What is the InChIKey of decoxy-diethyl-(6-ethyloctan-3-yloxy)silane?
The InChIKey is DHTNWMTXAZQQPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52O2Si/c1-7-13-14-15-16-17-18-19-22-25-27(11-5,12-6)26-24(10-4)21-20-23(8-2)9-3/h23-24H,7-22H2,1-6H3.
What are the key properties of decoxy-diethyl-(6-ethyloctan-3-yloxy)silane?
decoxy-diethyl-(6-ethyloctan-3-yloxy)silane has a molecular weight of 400.76 g/mol, XLogP of 8.64, 20 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for decoxy-diethyl-(6-ethyloctan-3-yloxy)silane is sourced from PubChem (CID 91744124), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).