diethoxy-heptadecyl-pentadecylsilane

C36H76O2Si — CID 139614360

IUPACdiethoxy-heptadecyl-pentadecylsilane
SMILESCCCCCCCCCCCCCCCCC[Si](CCCCCCCCCCCCCCC)(OCC)OCC
InChIInChI=1S/C36H76O2Si/c1-5-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-39(37-7-3,38-8-4)35-33-31-29-27-25-23-20-18-16-14-12-10-6-2/h5-36H2,1-4H3
InChIKeyYUIACKMCLKTGAA-UHFFFAOYSA-N
MW569.09 g/mol
LogP13.46
Rot. Bonds34

About diethoxy-heptadecyl-pentadecylsilane

diethoxy-heptadecyl-pentadecylsilane (PubChem CID 139614360) has the molecular formula C36H76O2Si and a molecular weight of 569.09 g/mol. Its IUPAC name is diethoxy-heptadecyl-pentadecylsilane.

Molecular Properties

Compound Namediethoxy-heptadecyl-pentadecylsilane
PubChem CID139614360
Molecular FormulaC36H76O2Si
Molecular Weight569.09 g/mol
Exact Mass568.56
IUPAC Namediethoxy-heptadecyl-pentadecylsilane
SMILESCCCCCCCCCCCCCCCCC[Si](CCCCCCCCCCCCCCC)(OCC)OCC
InChIInChI=1S/C36H76O2Si/c1-5-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-39(37-7-3,38-8-4)35-33-31-29-27-25-23-20-18-16-14-12-10-6-2/h5-36H2,1-4H3
InChIKeyYUIACKMCLKTGAA-UHFFFAOYSA-N
XLogP13.46
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds34
Heavy Atoms39
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500569.09
LogP ≤ 513.46
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

diethoxy-hexadecyl-tridecylsilane
CID 139614117
diethoxy-icosyl-undecylsilane
CID 139614143
decyl-diethoxy-tridecylsilane
CID 139614334
butyl-diethoxy-tetradecylsilane
CID 139614088
diethoxy-nonyl-propylsilane
CID 139614051
butoxy-ethoxy-dioctylsilane
CID 89350080
diethoxy-ethyl-tetradecylsilane
CID 139614055
diethoxy-ethyl-hexacosylsilane
CID 153322873
ethoxy-methoxy-propyl-tetradecylsilane
CID 141078244
6-[6-aminohexyl(diethoxy)silyl]hexan-1-amine
CID 139707876
triethoxy(henicosyl)silane
CID 141362894
dodecyl(triethoxy)silane;tridecane
CID 174970002

Frequently Asked Questions

What is the IUPAC name of diethoxy-heptadecyl-pentadecylsilane?
The IUPAC name of diethoxy-heptadecyl-pentadecylsilane (CID 139614360) is diethoxy-heptadecyl-pentadecylsilane.
What is the SMILES notation for diethoxy-heptadecyl-pentadecylsilane?
The canonical SMILES for diethoxy-heptadecyl-pentadecylsilane is CCCCCCCCCCCCCCCCC[Si](CCCCCCCCCCCCCCC)(OCC)OCC.
What is the InChIKey of diethoxy-heptadecyl-pentadecylsilane?
The InChIKey is YUIACKMCLKTGAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C36H76O2Si/c1-5-9-11-13-15-17-19-21-22-24-26-28-30-32-34-36-39(37-7-3,38-8-4)35-33-31-29-27-25-23-20-18-16-14-12-10-6-2/h5-36H2,1-4H3.
What are the key properties of diethoxy-heptadecyl-pentadecylsilane?
diethoxy-heptadecyl-pentadecylsilane has a molecular weight of 569.09 g/mol, XLogP of 13.46, 34 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for diethoxy-heptadecyl-pentadecylsilane is sourced from PubChem (CID 139614360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).