decyl-diethoxy-tridecylsilane

C27H58O2Si — CID 139614334

IUPACdecyl-diethoxy-tridecylsilane
SMILESCCCCCCCCCCCCC[Si](CCCCCCCCCC)(OCC)OCC
InChIInChI=1S/C27H58O2Si/c1-5-9-11-13-15-17-18-19-21-23-25-27-30(28-7-3,29-8-4)26-24-22-20-16-14-12-10-6-2/h5-27H2,1-4H3
InChIKeyJOJAOYAWSSGFKB-UHFFFAOYSA-N
MW442.85 g/mol
LogP9.95
Rot. Bonds25

About decyl-diethoxy-tridecylsilane

decyl-diethoxy-tridecylsilane (PubChem CID 139614334) has the molecular formula C27H58O2Si and a molecular weight of 442.85 g/mol. Its IUPAC name is decyl-diethoxy-tridecylsilane.

Molecular Properties

Compound Namedecyl-diethoxy-tridecylsilane
PubChem CID139614334
Molecular FormulaC27H58O2Si
Molecular Weight442.85 g/mol
Exact Mass442.42
IUPAC Namedecyl-diethoxy-tridecylsilane
SMILESCCCCCCCCCCCCC[Si](CCCCCCCCCC)(OCC)OCC
InChIInChI=1S/C27H58O2Si/c1-5-9-11-13-15-17-18-19-21-23-25-27-30(28-7-3,29-8-4)26-24-22-20-16-14-12-10-6-2/h5-27H2,1-4H3
InChIKeyJOJAOYAWSSGFKB-UHFFFAOYSA-N
XLogP9.95
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds25
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500442.85
LogP ≤ 59.95
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'}

Analyze decyl-diethoxy-tridecylsilane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

diethoxy-heptadecyl-pentadecylsilane
CID 139614360
diethoxy-hexadecyl-tridecylsilane
CID 139614117
diethoxy-icosyl-undecylsilane
CID 139614143
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 decyl-diethoxy-tridecylsilane?
The IUPAC name of decyl-diethoxy-tridecylsilane (CID 139614334) is decyl-diethoxy-tridecylsilane.
What is the SMILES notation for decyl-diethoxy-tridecylsilane?
The canonical SMILES for decyl-diethoxy-tridecylsilane is CCCCCCCCCCCCC[Si](CCCCCCCCCC)(OCC)OCC.
What is the InChIKey of decyl-diethoxy-tridecylsilane?
The InChIKey is JOJAOYAWSSGFKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H58O2Si/c1-5-9-11-13-15-17-18-19-21-23-25-27-30(28-7-3,29-8-4)26-24-22-20-16-14-12-10-6-2/h5-27H2,1-4H3.
What are the key properties of decyl-diethoxy-tridecylsilane?
decyl-diethoxy-tridecylsilane has a molecular weight of 442.85 g/mol, XLogP of 9.95, 25 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for decyl-diethoxy-tridecylsilane is sourced from PubChem (CID 139614334), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).