(5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one

C21H38O4Si2 — CID 10716520

About (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one

(5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one (PubChem CID 10716520) has the molecular formula C21H38O4Si2 and a molecular weight of 410.70 g/mol. Its IUPAC name is (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one.

Molecular Properties

• Compound Name: (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one
• PubChem CID: 10716520
• Molecular Formula: C21H38O4Si2
• Molecular Weight: 410.70 g/mol
• Exact Mass: 410.23
• IUPAC Name: (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one
• SMILES: CC(C)(C)[Si](C)(C)OC/C=C/C1=C/C(=C\CO[Si](C)(C)C(C)(C)C)OC1=O
• InChI: InChI=1S/C21H38O4Si2/c1-20(2,3)26(7,8)23-14-11-12-17-16-18(25-19(17)22)13-15-24-27(9,10)21(4,5)6/h11-13,16H,14-15H2,1-10H3/b12-11+,18-13+
• InChIKey: LVUWEHWXTJOYRK-RZMWGWOTSA-N
• XLogP: 5.95
• TPSA: 44.76 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 7
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	410.70
LogP ≤ 5	5.95
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one?

The IUPAC name of (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one (CID 10716520) is (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one.

What is the SMILES notation for (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one?

The canonical SMILES for (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one is CC(C)(C)[Si](C)(C)OC/C=C/C1=C/C(=C\CO[Si](C)(C)C(C)(C)C)OC1=O.

What is the InChIKey of (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one?

The InChIKey is LVUWEHWXTJOYRK-RZMWGWOTSA-N. The full InChI is InChI=1S/C21H38O4Si2/c1-20(2,3)26(7,8)23-14-11-12-17-16-18(25-19(17)22)13-15-24-27(9,10)21(4,5)6/h11-13,16H,14-15H2,1-10H3/b12-11+,18-13+.

What are the key properties of (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one?

(5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one has a molecular weight of 410.70 g/mol, XLogP of 5.95, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (5E)-5-[2-[tert-butyl(dimethyl)silyl]oxyethylidene]-3-[(E)-3-[tert-butyl(dimethyl)silyl]oxyprop-1-enyl]furan-2-one is sourced from PubChem (CID 10716520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).