bis[tert-butyl(dimethyl)silyl] propanedioate

C15H32O4Si2 — CID 528582

IUPACbis[tert-butyl(dimethyl)silyl] propanedioate
SMILESCC(C)(C)[Si](C)(C)OC(=O)CC(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32O4Si2/c1-14(2,3)20(7,8)18-12(16)11-13(17)19-21(9,10)15(4,5)6/h11H2,1-10H3
InChIKeyKSYBDZGPOBPAMS-UHFFFAOYSA-N
MW332.59 g/mol
LogP4.47
Rot. Bonds4

About bis[tert-butyl(dimethyl)silyl] propanedioate

bis[tert-butyl(dimethyl)silyl] propanedioate (PubChem CID 528582) has the molecular formula C15H32O4Si2 and a molecular weight of 332.59 g/mol. Its IUPAC name is bis[tert-butyl(dimethyl)silyl] propanedioate.

Molecular Properties

Compound Namebis[tert-butyl(dimethyl)silyl] propanedioate
PubChem CID528582
Molecular FormulaC15H32O4Si2
Molecular Weight332.59 g/mol
Exact Mass332.18
IUPAC Namebis[tert-butyl(dimethyl)silyl] propanedioate
SMILESCC(C)(C)[Si](C)(C)OC(=O)CC(=O)O[Si](C)(C)C(C)(C)C
InChIInChI=1S/C15H32O4Si2/c1-14(2,3)20(7,8)18-12(16)11-13(17)19-21(9,10)15(4,5)6/h11H2,1-10H3
InChIKeyKSYBDZGPOBPAMS-UHFFFAOYSA-N
XLogP4.47
TPSA52.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.59
LogP ≤ 54.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of bis[tert-butyl(dimethyl)silyl] propanedioate?
The IUPAC name of bis[tert-butyl(dimethyl)silyl] propanedioate (CID 528582) is bis[tert-butyl(dimethyl)silyl] propanedioate.
What is the SMILES notation for bis[tert-butyl(dimethyl)silyl] propanedioate?
The canonical SMILES for bis[tert-butyl(dimethyl)silyl] propanedioate is CC(C)(C)[Si](C)(C)OC(=O)CC(=O)O[Si](C)(C)C(C)(C)C.
What is the InChIKey of bis[tert-butyl(dimethyl)silyl] propanedioate?
The InChIKey is KSYBDZGPOBPAMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O4Si2/c1-14(2,3)20(7,8)18-12(16)11-13(17)19-21(9,10)15(4,5)6/h11H2,1-10H3.
What are the key properties of bis[tert-butyl(dimethyl)silyl] propanedioate?
bis[tert-butyl(dimethyl)silyl] propanedioate has a molecular weight of 332.59 g/mol, XLogP of 4.47, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis[tert-butyl(dimethyl)silyl] propanedioate is sourced from PubChem (CID 528582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).