1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane

C33H60Si3 — CID 12981875

IUPAC1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane
SMILESCC(=C=C1[Si](C)(C)C(=C=C(C)CC(C)(C)C)[Si](C)(C)C(=C=C(C)CC(C)(C)C)[Si]1(C)C)CC(C)(C)C
InChIInChI=1S/C33H60Si3/c1-25(22-31(4,5)6)19-28-34(13,14)29(20-26(2)23-32(7,8)9)36(17,18)30(35(28,15)16)21-27(3)24-33(10,11)12/h22-24H2,1-18H3
InChIKeyOILMMJXEKJDJEB-UHFFFAOYSA-N
MW541.10 g/mol
LogP11.08
Rot. Bonds3

About 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane

1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane (PubChem CID 12981875) has the molecular formula C33H60Si3 and a molecular weight of 541.10 g/mol. Its IUPAC name is 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane.

Molecular Properties

Compound Name1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane
PubChem CID12981875
Molecular FormulaC33H60Si3
Molecular Weight541.10 g/mol
Exact Mass540.40
IUPAC Name1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane
SMILESCC(=C=C1[Si](C)(C)C(=C=C(C)CC(C)(C)C)[Si](C)(C)C(=C=C(C)CC(C)(C)C)[Si]1(C)C)CC(C)(C)C
InChIInChI=1S/C33H60Si3/c1-25(22-31(4,5)6)19-28-34(13,14)29(20-26(2)23-32(7,8)9)36(17,18)30(35(28,15)16)21-27(3)24-33(10,11)12/h22-24H2,1-18H3
InChIKeyOILMMJXEKJDJEB-UHFFFAOYSA-N
XLogP11.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms36
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500541.10
LogP ≤ 511.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane?
The IUPAC name of 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane (CID 12981875) is 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane.
What is the SMILES notation for 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane?
The canonical SMILES for 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane is CC(=C=C1[Si](C)(C)C(=C=C(C)CC(C)(C)C)[Si](C)(C)C(=C=C(C)CC(C)(C)C)[Si]1(C)C)CC(C)(C)C.
What is the InChIKey of 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane?
The InChIKey is OILMMJXEKJDJEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H60Si3/c1-25(22-31(4,5)6)19-28-34(13,14)29(20-26(2)23-32(7,8)9)36(17,18)30(35(28,15)16)21-27(3)24-33(10,11)12/h22-24H2,1-18H3.
What are the key properties of 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane?
1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane has a molecular weight of 541.10 g/mol, XLogP of 11.08, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3,5,5-hexamethyl-2,4,6-tris(2,4,4-trimethylpent-1-enylidene)-1,3,5-trisilinane is sourced from PubChem (CID 12981875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).