triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane

C15H36O6S3Si2 — CID 23499918

IUPACtriethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane
SMILESCCO[Si](OCC)(OCC)C(CC)(SSS)[Si](OCC)(OCC)OCC
InChIInChI=1S/C15H36O6S3Si2/c1-8-15(23-24-22,25(16-9-2,17-10-3)18-11-4)26(19-12-5,20-13-6)21-14-7/h22H,8-14H2,1-7H3
InChIKeyNIVMONVDRHWGBW-UHFFFAOYSA-N
MW464.82 g/mol
LogP4.54
Rot. Bonds17

About triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane

triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane (PubChem CID 23499918) has the molecular formula C15H36O6S3Si2 and a molecular weight of 464.82 g/mol. Its IUPAC name is triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane.

Molecular Properties

Compound Nametriethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane
PubChem CID23499918
Molecular FormulaC15H36O6S3Si2
Molecular Weight464.82 g/mol
Exact Mass464.12
IUPAC Nametriethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane
SMILESCCO[Si](OCC)(OCC)C(CC)(SSS)[Si](OCC)(OCC)OCC
InChIInChI=1S/C15H36O6S3Si2/c1-8-15(23-24-22,25(16-9-2,17-10-3)18-11-4)26(19-12-5,20-13-6)21-14-7/h22H,8-14H2,1-7H3
InChIKeyNIVMONVDRHWGBW-UHFFFAOYSA-N
XLogP4.54
TPSA55.38 Ų
H-Bond Donors1
H-Bond Acceptors9
Rotatable Bonds17
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500464.82
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'thiol_2', 'substructure': 'N/A'}

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Related Compounds

triethoxy(2-triethoxysilylpropan-2-yl)silane
CID 18432084
triethoxy-[1,1,1,3,3,3-hexafluoro-2-(trifluoromethyl)propan-2-yl]silane
CID 23523578
triethoxy(3-ethylhexan-3-yl)silane
CID 175030722
CID 87651559
CID 87651559
triethoxy(2,3,3-trimethylbutan-2-yl)silane
CID 18000011
(2-ethyl-2-triethoxysilylbutyl)-oxido-oxophosphanium
CID 175037304
1,1-diethoxyethyl(triethoxy)silane
CID 175450759
3-ethyl-3-triethoxysilylpentan-1-amine
CID 23083469
[diethoxy(triethoxysilyl)methyl] triethyl silicate
CID 58810725
tert-butyl-diethoxy-[(2-methylpropan-2-yl)oxy]silane
CID 139722194
triethoxy-[1-(trisulfanyl)propyl]silane
CID 18355895
(3-methyl-3-triethoxysilylbutyl)phosphane
CID 174985696

Frequently Asked Questions

What is the IUPAC name of triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane?
The IUPAC name of triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane (CID 23499918) is triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane.
What is the SMILES notation for triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane?
The canonical SMILES for triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane is CCO[Si](OCC)(OCC)C(CC)(SSS)[Si](OCC)(OCC)OCC.
What is the InChIKey of triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane?
The InChIKey is NIVMONVDRHWGBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H36O6S3Si2/c1-8-15(23-24-22,25(16-9-2,17-10-3)18-11-4)26(19-12-5,20-13-6)21-14-7/h22H,8-14H2,1-7H3.
What are the key properties of triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane?
triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane has a molecular weight of 464.82 g/mol, XLogP of 4.54, 17 rotatable bonds, 1 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for triethoxy-[1-triethoxysilyl-1-(trisulfanyl)propyl]silane is sourced from PubChem (CID 23499918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).