[2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane

C27H78O10Si8 — CID 123254368

IUPAC[2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane
SMILESC=C[Si](OC)(OC)OC.CC.CC.CC.CCC[Si](C)(C)O[Si](CC[Si](C)(C)O[Si](O[SiH2]C)(O[SiH2]C)O[SiH2]C)(OCC)OCC
InChIInChI=1S/C16H48O7Si7.C5H12O3Si.3C2H6/c1-11-14-27(7,8)22-29(17-12-2,18-13-3)16-15-28(9,10)23-30(19-24-4,20-25-5)21-26-6;1-5-9(6-2,7-3)8-4;3*1-2/h11-16,24-26H2,1-10H3;5H,1H2,2-4H3;3*1-2H3
InChIKeyLPLOCYCYMNOZOE-UHFFFAOYSA-N
MW787.60 g/mol
LogP6.40
Rot. Bonds23

About [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane

[2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane (PubChem CID 123254368) has the molecular formula C27H78O10Si8 and a molecular weight of 787.60 g/mol. Its IUPAC name is [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane.

Molecular Properties

Compound Name[2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane
PubChem CID123254368
Molecular FormulaC27H78O10Si8
Molecular Weight787.60 g/mol
Exact Mass786.37
IUPAC Name[2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane
SMILESC=C[Si](OC)(OC)OC.CC.CC.CC.CCC[Si](C)(C)O[Si](CC[Si](C)(C)O[Si](O[SiH2]C)(O[SiH2]C)O[SiH2]C)(OCC)OCC
InChIInChI=1S/C16H48O7Si7.C5H12O3Si.3C2H6/c1-11-14-27(7,8)22-29(17-12-2,18-13-3)16-15-28(9,10)23-30(19-24-4,20-25-5)21-26-6;1-5-9(6-2,7-3)8-4;3*1-2/h11-16,24-26H2,1-10H3;5H,1H2,2-4H3;3*1-2H3
InChIKeyLPLOCYCYMNOZOE-UHFFFAOYSA-N
XLogP6.40
TPSA92.30 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds23
Heavy Atoms45
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500787.60
LogP ≤ 56.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane?
The IUPAC name of [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane (CID 123254368) is [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane.
What is the SMILES notation for [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane?
The canonical SMILES for [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane is C=C[Si](OC)(OC)OC.CC.CC.CC.CCC[Si](C)(C)O[Si](CC[Si](C)(C)O[Si](O[SiH2]C)(O[SiH2]C)O[SiH2]C)(OCC)OCC.
What is the InChIKey of [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane?
The InChIKey is LPLOCYCYMNOZOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H48O7Si7.C5H12O3Si.3C2H6/c1-11-14-27(7,8)22-29(17-12-2,18-13-3)16-15-28(9,10)23-30(19-24-4,20-25-5)21-26-6;1-5-9(6-2,7-3)8-4;3*1-2/h11-16,24-26H2,1-10H3;5H,1H2,2-4H3;3*1-2H3.
What are the key properties of [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane?
[2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane has a molecular weight of 787.60 g/mol, XLogP of 6.40, 23 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[dimethyl(propyl)silyl]oxy-diethoxysilyl]ethyl-dimethylsilyl] tris(methylsilyl) silicate;ethane;ethenyl(trimethoxy)silane is sourced from PubChem (CID 123254368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).