trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane

C21H46O4Si3 — CID 102366439

IUPACtrimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane
SMILESCC(C)[Si](OC[C@H]1OC=C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)(C(C)C)C(C)C
InChIInChI=1S/C21H46O4Si3/c1-16(2)28(17(3)4,18(5)6)23-15-20-21(25-27(10,11)12)19(13-14-22-20)24-26(7,8)9/h13-14,16-21H,15H2,1-12H3/t19-,20-,21+/m1/s1
InChIKeyYBXXZNZLSPLDSY-NJYVYQBISA-N
MW446.85 g/mol
LogP6.53
Rot. Bonds10

About trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane

trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane (PubChem CID 102366439) has the molecular formula C21H46O4Si3 and a molecular weight of 446.85 g/mol. Its IUPAC name is trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane.

Molecular Properties

Compound Nametrimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane
PubChem CID102366439
Molecular FormulaC21H46O4Si3
Molecular Weight446.85 g/mol
Exact Mass446.27
IUPAC Nametrimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane
SMILESCC(C)[Si](OC[C@H]1OC=C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)(C(C)C)C(C)C
InChIInChI=1S/C21H46O4Si3/c1-16(2)28(17(3)4,18(5)6)23-15-20-21(25-27(10,11)12)19(13-14-22-20)24-26(7,8)9/h13-14,16-21H,15H2,1-12H3/t19-,20-,21+/m1/s1
InChIKeyYBXXZNZLSPLDSY-NJYVYQBISA-N
XLogP6.53
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500446.85
LogP ≤ 56.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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 trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane?
The IUPAC name of trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane (CID 102366439) is trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane.
What is the SMILES notation for trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane?
The canonical SMILES for trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane is CC(C)[Si](OC[C@H]1OC=C[C@@H](O[Si](C)(C)C)[C@@H]1O[Si](C)(C)C)(C(C)C)C(C)C.
What is the InChIKey of trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane?
The InChIKey is YBXXZNZLSPLDSY-NJYVYQBISA-N. The full InChI is InChI=1S/C21H46O4Si3/c1-16(2)28(17(3)4,18(5)6)23-15-20-21(25-27(10,11)12)19(13-14-22-20)24-26(7,8)9/h13-14,16-21H,15H2,1-12H3/t19-,20-,21+/m1/s1.
What are the key properties of trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane?
trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane has a molecular weight of 446.85 g/mol, XLogP of 6.53, 10 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for trimethyl-[[(2R,3R,4R)-3-trimethylsilyloxy-2-[tri(propan-2-yl)silyloxymethyl]-3,4-dihydro-2H-pyran-4-yl]oxy]silane is sourced from PubChem (CID 102366439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).