[(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane

C24H49IO3Si2 — CID 101227355

About [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane

[(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane (PubChem CID 101227355) has the molecular formula C24H49IO3Si2 and a molecular weight of 568.73 g/mol. Its IUPAC name is [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane.

Molecular Properties

• Compound Name: [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
• PubChem CID: 101227355
• Molecular Formula: C24H49IO3Si2
• Molecular Weight: 568.73 g/mol
• Exact Mass: 568.23
• IUPAC Name: [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane
• SMILES: CC(C)[Si](O[C@@H]1[C@@H](C)OC(I)=C[C@H]1O[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C
• InChI: InChI=1S/C24H49IO3Si2/c1-15(2)29(16(3)4,17(5)6)27-22-14-23(25)26-21(13)24(22)28-30(18(7)8,19(9)10)20(11)12/h14-22,24H,1-13H3/t21-,22-,24-/m1/s1
• InChIKey: GUALGHJHLPWUAM-CQOQZXRMSA-N
• XLogP: 8.80
• TPSA: 27.69 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 10
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	568.73
LogP ≤ 5	8.80
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?

The IUPAC name of [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane (CID 101227355) is [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane.

What is the SMILES notation for [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?

The canonical SMILES for [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane is CC(C)[Si](O[C@@H]1[C@@H](C)OC(I)=C[C@H]1O[Si](C(C)C)(C(C)C)C(C)C)(C(C)C)C(C)C.

What is the InChIKey of [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?

The InChIKey is GUALGHJHLPWUAM-CQOQZXRMSA-N. The full InChI is InChI=1S/C24H49IO3Si2/c1-15(2)29(16(3)4,17(5)6)27-22-14-23(25)26-21(13)24(22)28-30(18(7)8,19(9)10)20(11)12/h14-22,24H,1-13H3/t21-,22-,24-/m1/s1.

What are the key properties of [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane?

[(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane has a molecular weight of 568.73 g/mol, XLogP of 8.80, 10 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for [(2R,3R,4R)-6-iodo-2-methyl-3-tri(propan-2-yl)silyloxy-3,4-dihydro-2H-pyran-4-yl]oxy-tri(propan-2-yl)silane is sourced from PubChem (CID 101227355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).