1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne

C28H56Si8 — CID 11093325

IUPAC1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne
SMILESC[Si]1(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C1
InChIInChI=1S/C28H56Si8/c1-29(2)17-18-31(5,6)26-33(9,10)21-22-35(13,14)28-36(15,16)24-23-34(11,12)27-32(7,8)20-19-30(3,4)25-29/h25-28H2,1-16H3
InChIKeyMLQRPUMRMJKVQP-UHFFFAOYSA-N
MW617.44 g/mol
LogP8.15
Rot. Bonds

About 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne

1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne (PubChem CID 11093325) has the molecular formula C28H56Si8 and a molecular weight of 617.44 g/mol. Its IUPAC name is 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne.

Molecular Properties

Compound Name1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne
PubChem CID11093325
Molecular FormulaC28H56Si8
Molecular Weight617.44 g/mol
Exact Mass616.25
IUPAC Name1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne
SMILESC[Si]1(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C1
InChIInChI=1S/C28H56Si8/c1-29(2)17-18-31(5,6)26-33(9,10)21-22-35(13,14)28-36(15,16)24-23-34(11,12)27-32(7,8)20-19-30(3,4)25-29/h25-28H2,1-16H3
InChIKeyMLQRPUMRMJKVQP-UHFFFAOYSA-N
XLogP8.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500617.44
LogP ≤ 58.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne with MolForge

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Related Compounds

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CID 84564
Tris(triethylsilyl)silane
CID 71311040
Tetrakis(trimethylsilylethynyl)silane
CID 11080239
2,7-Disilaoct-4-yne, 2,2,7,7-tetramethyl-3,3,6,6-tetrakis(trimethylsilyl)-
CID 140781
Silane, 1,3-butadiyne-1,4-diylbis[tris(1-methylethyl)-
CID 11405807
1,1,2,2,5,5,6,6,9,9,10,10-Dodecamethyl-1,2,5,6,9,10-hexasila-3,7,11-cyclododecatriyne
CID 13168388
1,3-Bis(triisopropylsilyl)propyne
CID 357780
Dimethyl-bis(2-trimethylsilylethynyl)silane
CID 11436685
1,1'-(1,3,5-Hexatriyne-1,6-diyl)bis(1,1,1-tris(1-methylethyl)silane
CID 11825230
1,1,4,4,7,7,10,10-Octamethyl-1,4,7,10-tetrasilacyclododeca-2,8-diyne
CID 13446827
Tetrakis(trimethylsilylethynyl)stannane
CID 14791865
Tri(propan-2-yl)-[8-tri(propan-2-yl)silylocta-1,3,5,7-tetraynyl]silane
CID 66553459

Frequently Asked Questions

What is the IUPAC name of 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne?
The IUPAC name of 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne (CID 11093325) is 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne.
What is the SMILES notation for 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne?
The canonical SMILES for 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne is C[Si]1(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C[Si](C)(C)C#C[Si](C)(C)C1.
What is the InChIKey of 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne?
The InChIKey is MLQRPUMRMJKVQP-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H56Si8/c1-29(2)17-18-31(5,6)26-33(9,10)21-22-35(13,14)28-36(15,16)24-23-34(11,12)27-32(7,8)20-19-30(3,4)25-29/h25-28H2,1-16H3.
What are the key properties of 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne?
1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne has a molecular weight of 617.44 g/mol, XLogP of 8.15, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3,6,6,8,8,11,11,13,13,16,16,18,18-hexadecamethyl-1,3,6,8,11,13,16,18-octasilacycloicosa-4,9,14,19-tetrayne is sourced from PubChem (CID 11093325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).