cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane

C17H33NO5Si4 — CID 174954025

IUPACcyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESC=C[Si]1(C=C)O[Si](C=C)(C=C)O[Si](CC)(CC)O[Si](CC)(CC)O1.N#CO
InChIInChI=1S/C16H32O4Si4.CHNO/c1-9-21(10-2)17-22(11-3,12-4)19-24(15-7,16-8)20-23(13-5,14-6)18-21;2-1-3/h9-12H,1-4,13-16H2,5-8H3;3H
InChIKeyGTAAFXHTEYETLV-UHFFFAOYSA-N
MW443.80 g/mol
LogP4.66
Rot. Bonds8

About cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane

cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (PubChem CID 174954025) has the molecular formula C17H33NO5Si4 and a molecular weight of 443.80 g/mol. Its IUPAC name is cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.

Molecular Properties

Compound Namecyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
PubChem CID174954025
Molecular FormulaC17H33NO5Si4
Molecular Weight443.80 g/mol
Exact Mass443.14
IUPAC Namecyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane
SMILESC=C[Si]1(C=C)O[Si](C=C)(C=C)O[Si](CC)(CC)O[Si](CC)(CC)O1.N#CO
InChIInChI=1S/C16H32O4Si4.CHNO/c1-9-21(10-2)17-22(11-3,12-4)19-24(15-7,16-8)20-23(13-5,14-6)18-21;2-1-3/h9-12H,1-4,13-16H2,5-8H3;3H
InChIKeyGTAAFXHTEYETLV-UHFFFAOYSA-N
XLogP4.66
TPSA80.94 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.80
LogP ≤ 54.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

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CID 175565406
2,4,6,8,10,12,14,16,18,20,22,24-dodecakis(ethenyl)-2,4,6,8,10,12,14,16,18,20,22,24-dodecaethyl-1,3,5,7,9,11,13,15,17,19,21,23-dodecaoxa-2,4,6,8,10,12,14,16,18,20,22,24-dodecasilacyclotetracosane
CID 89485968
2,6-dichloro-2,4,4,6,8,8,10,10-octaethyl-1,3,5,7,9,2,4,6,8,10-pentaoxapentasilecane
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CID 636148
1,2,3,4-tetrakis(ethenyl)-1,2,3,4-tetraethyltetrasiletane
CID 139616644
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CID 21361150
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Frequently Asked Questions

What is the IUPAC name of cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The IUPAC name of cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane (CID 174954025) is cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane.
What is the SMILES notation for cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The canonical SMILES for cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is C=C[Si]1(C=C)O[Si](C=C)(C=C)O[Si](CC)(CC)O[Si](CC)(CC)O1.N#CO.
What is the InChIKey of cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
The InChIKey is GTAAFXHTEYETLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32O4Si4.CHNO/c1-9-21(10-2)17-22(11-3,12-4)19-24(15-7,16-8)20-23(13-5,14-6)18-21;2-1-3/h9-12H,1-4,13-16H2,5-8H3;3H.
What are the key properties of cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane?
cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane has a molecular weight of 443.80 g/mol, XLogP of 4.66, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cyanic acid;2,2,4,4-tetrakis(ethenyl)-6,6,8,8-tetraethyl-1,3,5,7,2,4,6,8-tetraoxatetrasilocane is sourced from PubChem (CID 174954025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).