2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde

C11H20N2O3Si2 — CID 553672

IUPAC2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde
SMILESC[Si](C)(C)Oc1cc(C=O)nc(O[Si](C)(C)C)n1
InChIInChI=1S/C11H20N2O3Si2/c1-17(2,3)15-10-7-9(8-14)12-11(13-10)16-18(4,5)6/h7-8H,1-6H3
InChIKeyLGDSSMQSQDKUBV-UHFFFAOYSA-N
MW284.46 g/mol
LogP2.72
Rot. Bonds5

About 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde

2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde (PubChem CID 553672) has the molecular formula C11H20N2O3Si2 and a molecular weight of 284.46 g/mol. Its IUPAC name is 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde.

Molecular Properties

Compound Name2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde
PubChem CID553672
Molecular FormulaC11H20N2O3Si2
Molecular Weight284.46 g/mol
Exact Mass284.10
IUPAC Name2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde
SMILESC[Si](C)(C)Oc1cc(C=O)nc(O[Si](C)(C)C)n1
InChIInChI=1S/C11H20N2O3Si2/c1-17(2,3)15-10-7-9(8-14)12-11(13-10)16-18(4,5)6/h7-8H,1-6H3
InChIKeyLGDSSMQSQDKUBV-UHFFFAOYSA-N
XLogP2.72
TPSA61.31 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.46
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde?
The IUPAC name of 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde (CID 553672) is 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde.
What is the SMILES notation for 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde?
The canonical SMILES for 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde is C[Si](C)(C)Oc1cc(C=O)nc(O[Si](C)(C)C)n1.
What is the InChIKey of 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde?
The InChIKey is LGDSSMQSQDKUBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3Si2/c1-17(2,3)15-10-7-9(8-14)12-11(13-10)16-18(4,5)6/h7-8H,1-6H3.
What are the key properties of 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde?
2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde has a molecular weight of 284.46 g/mol, XLogP of 2.72, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-bis(trimethylsilyloxy)pyrimidine-4-carbaldehyde is sourced from PubChem (CID 553672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).