(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one

C18H36O4Si2 — CID 134922321

About (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one

(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one (PubChem CID 134922321) has the molecular formula C18H36O4Si2 and a molecular weight of 372.65 g/mol. Its IUPAC name is (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one.

Molecular Properties

• Compound Name: (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one
• PubChem CID: 134922321
• Molecular Formula: C18H36O4Si2
• Molecular Weight: 372.65 g/mol
• Exact Mass: 372.22
• IUPAC Name: (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one
• SMILES: CC(C)(C)[Si](C)(C)OC[C@H]1OC=CC(=O)[C@H]1O[Si](C)(C)C(C)(C)C
• InChI: InChI=1S/C18H36O4Si2/c1-17(2,3)23(7,8)21-13-15-16(14(19)11-12-20-15)22-24(9,10)18(4,5)6/h11-12,15-16H,13H2,1-10H3/t15-,16-/m1/s1
• InChIKey: IRDVNIPPGKVBPV-HZPDHXFCSA-N
• XLogP: 4.88
• TPSA: 44.76 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.65
LogP ≤ 5	4.88
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 (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one?

The IUPAC name of (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one (CID 134922321) is (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one.

What is the SMILES notation for (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one?

The canonical SMILES for (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one is CC(C)(C)[Si](C)(C)OC[C@H]1OC=CC(=O)[C@H]1O[Si](C)(C)C(C)(C)C.

What is the InChIKey of (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one?

The InChIKey is IRDVNIPPGKVBPV-HZPDHXFCSA-N. The full InChI is InChI=1S/C18H36O4Si2/c1-17(2,3)23(7,8)21-13-15-16(14(19)11-12-20-15)22-24(9,10)18(4,5)6/h11-12,15-16H,13H2,1-10H3/t15-,16-/m1/s1.

What are the key properties of (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one?

(2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one has a molecular weight of 372.65 g/mol, XLogP of 4.88, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for (2R,3S)-3-[tert-butyl(dimethyl)silyl]oxy-2-[[tert-butyl(dimethyl)silyl]oxymethyl]-2,3-dihydropyran-4-one is sourced from PubChem (CID 134922321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).