samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane

C28H48OSi2Sm — CID 87933292

IUPACsamarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane
SMILESCC1=C(C)C(C)(C)C(C2(C3=C([Si](C)(C)C)C(C)=C(C)C3(C)C)CCCO2)=C1[Si](C)(C)C.[Sm]
InChIInChI=1S/C28H48OSi2.Sm/c1-18-20(3)26(5,6)24(22(18)30(9,10)11)28(16-15-17-29-28)25-23(31(12,13)14)19(2)21(4)27(25,7)8;/h15-17H2,1-14H3;
InChIKeyZINLJABQDWACTD-UHFFFAOYSA-N
MW607.22 g/mol
LogP8.64
Rot. Bonds4

About samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane

samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane (PubChem CID 87933292) has the molecular formula C28H48OSi2Sm and a molecular weight of 607.22 g/mol. Its IUPAC name is samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane.

Molecular Properties

Compound Namesamarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane
PubChem CID87933292
Molecular FormulaC28H48OSi2Sm
Molecular Weight607.22 g/mol
Exact Mass608.24
IUPAC Namesamarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane
SMILESCC1=C(C)C(C)(C)C(C2(C3=C([Si](C)(C)C)C(C)=C(C)C3(C)C)CCCO2)=C1[Si](C)(C)C.[Sm]
InChIInChI=1S/C28H48OSi2.Sm/c1-18-20(3)26(5,6)24(22(18)30(9,10)11)28(16-15-17-29-28)25-23(31(12,13)14)19(2)21(4)27(25,7)8;/h15-17H2,1-14H3;
InChIKeyZINLJABQDWACTD-UHFFFAOYSA-N
XLogP8.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500607.22
LogP ≤ 58.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane with MolForge

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Launch Full Analysis

Related Compounds

Trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane
CID 22065612
2,2-Bis(3,4,5,5-tetramethyl-2-propan-2-ylcyclopenta-1,3-dien-1-yl)oxolane
CID 22065614
2,2-Bis(2-butyl-3,4,5,5-tetramethylcyclopenta-1,3-dien-1-yl)oxolane
CID 22065618
3-Iodo-2,2-bis(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;samarium
CID 22286650
3-Methyl-2,2-bis(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;samarium
CID 22286654
3-Methyl-2,2-bis(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane
CID 22286655
2-Methyl-2,3-bis(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;samarium
CID 87913141
2,2-Bis(3,4,5,5-tetramethyl-2-propan-2-ylcyclopenta-1,3-dien-1-yl)oxolane;samarium
CID 87933255
2,2-Bis(2-butyl-3,4,5,5-tetramethylcyclopenta-1,3-dien-1-yl)oxolane;samarium
CID 87933258
Samarium;trimethyl-[3,3,4,5-tetramethyl-2-(oxolan-2-yl)cyclopenta-1,4-dien-1-yl]silane
CID 87933789
Trimethyl-[3,3,4,5-tetramethyl-2-(oxolan-2-yl)cyclopenta-1,4-dien-1-yl]silane
CID 87933790
2-Methyl-2-(2,3,4,5,5-pentamethylcyclopenta-1,3-dien-1-yl)oxolane;samarium
CID 174382752

Frequently Asked Questions

What is the IUPAC name of samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane?
The IUPAC name of samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane (CID 87933292) is samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane.
What is the SMILES notation for samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane?
The canonical SMILES for samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane is CC1=C(C)C(C)(C)C(C2(C3=C([Si](C)(C)C)C(C)=C(C)C3(C)C)CCCO2)=C1[Si](C)(C)C.[Sm].
What is the InChIKey of samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane?
The InChIKey is ZINLJABQDWACTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H48OSi2.Sm/c1-18-20(3)26(5,6)24(22(18)30(9,10)11)28(16-15-17-29-28)25-23(31(12,13)14)19(2)21(4)27(25,7)8;/h15-17H2,1-14H3;.
What are the key properties of samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane?
samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane has a molecular weight of 607.22 g/mol, XLogP of 8.64, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for samarium;trimethyl-[3,3,4,5-tetramethyl-2-[2-(3,4,5,5-tetramethyl-2-trimethylsilylcyclopenta-1,3-dien-1-yl)oxolan-2-yl]cyclopenta-1,4-dien-1-yl]silane is sourced from PubChem (CID 87933292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).