dodecoxy-diethyl-(2-ethylhexoxy)silane

C24H52O2Si — CID 91744144

IUPACdodecoxy-diethyl-(2-ethylhexoxy)silane
SMILESCCCCCCCCCCCCO[Si](CC)(CC)OCC(CC)CCCC
InChIInChI=1S/C24H52O2Si/c1-6-11-13-14-15-16-17-18-19-20-22-25-27(9-4,10-5)26-23-24(8-3)21-12-7-2/h24H,6-23H2,1-5H3
InChIKeyCAJLSIPBBPQUTC-UHFFFAOYSA-N
MW400.76 g/mol
LogP8.64
Rot. Bonds21

About dodecoxy-diethyl-(2-ethylhexoxy)silane

dodecoxy-diethyl-(2-ethylhexoxy)silane (PubChem CID 91744144) has the molecular formula C24H52O2Si and a molecular weight of 400.76 g/mol. Its IUPAC name is dodecoxy-diethyl-(2-ethylhexoxy)silane.

Molecular Properties

Compound Namedodecoxy-diethyl-(2-ethylhexoxy)silane
PubChem CID91744144
Molecular FormulaC24H52O2Si
Molecular Weight400.76 g/mol
Exact Mass400.37
IUPAC Namedodecoxy-diethyl-(2-ethylhexoxy)silane
SMILESCCCCCCCCCCCCO[Si](CC)(CC)OCC(CC)CCCC
InChIInChI=1S/C24H52O2Si/c1-6-11-13-14-15-16-17-18-19-20-22-25-27(9-4,10-5)26-23-24(8-3)21-12-7-2/h24H,6-23H2,1-5H3
InChIKeyCAJLSIPBBPQUTC-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

Silane, (decyloxy)(1,1-dimethylethyl)dimethyl-
CID 529143
Silane, (1,1-dimethylethyl)dimethyl(octadecyloxy)-
CID 529170
Tetradecyl tert-butyldimethylsilyl ether
CID 529187
Silane, dimethyldi(2-ethylhexyloxy)
CID 85694064
Hexadecyl tert-butyldimethylsilyl ether
CID 529157
1,10-decanediol, tBDMS
CID 6430197
1,8-octanediol, tBDMS
CID 6430203
1-Dodecanol, DMTBS
CID 529148
Tert-butyl-heptadecoxy-dimethylsilane
CID 6429824
Tert-butyl-dimethyl-nonadecoxysilane
CID 6430216
1-Tridecanol, tBDMS
CID 6430224
1-Undecanol, tBDMS
CID 6430225

Frequently Asked Questions

What is the IUPAC name of dodecoxy-diethyl-(2-ethylhexoxy)silane?
The IUPAC name of dodecoxy-diethyl-(2-ethylhexoxy)silane (CID 91744144) is dodecoxy-diethyl-(2-ethylhexoxy)silane.
What is the SMILES notation for dodecoxy-diethyl-(2-ethylhexoxy)silane?
The canonical SMILES for dodecoxy-diethyl-(2-ethylhexoxy)silane is CCCCCCCCCCCCO[Si](CC)(CC)OCC(CC)CCCC.
What is the InChIKey of dodecoxy-diethyl-(2-ethylhexoxy)silane?
The InChIKey is CAJLSIPBBPQUTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H52O2Si/c1-6-11-13-14-15-16-17-18-19-20-22-25-27(9-4,10-5)26-23-24(8-3)21-12-7-2/h24H,6-23H2,1-5H3.
What are the key properties of dodecoxy-diethyl-(2-ethylhexoxy)silane?
dodecoxy-diethyl-(2-ethylhexoxy)silane 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 dodecoxy-diethyl-(2-ethylhexoxy)silane is sourced from PubChem (CID 91744144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).