trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate

C14H28N2O4Si3 — CID 520508

IUPACtrimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate
SMILESC[Si](C)(C)OC(=O)c1cc(O[Si](C)(C)C)nc(O[Si](C)(C)C)n1
InChIInChI=1S/C14H28N2O4Si3/c1-21(2,3)18-12-10-11(13(17)19-22(4,5)6)15-14(16-12)20-23(7,8)9/h10H,1-9H3
InChIKeyQOXWEKWDMOZSFV-UHFFFAOYSA-N
MW372.65 g/mol
LogP3.90
Rot. Bonds6

About trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate

trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate (PubChem CID 520508) has the molecular formula C14H28N2O4Si3 and a molecular weight of 372.65 g/mol. Its IUPAC name is trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate.

Molecular Properties

Compound Nametrimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate
PubChem CID520508
Molecular FormulaC14H28N2O4Si3
Molecular Weight372.65 g/mol
Exact Mass372.14
IUPAC Nametrimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate
SMILESC[Si](C)(C)OC(=O)c1cc(O[Si](C)(C)C)nc(O[Si](C)(C)C)n1
InChIInChI=1S/C14H28N2O4Si3/c1-21(2,3)18-12-10-11(13(17)19-22(4,5)6)15-14(16-12)20-23(7,8)9/h10H,1-9H3
InChIKeyQOXWEKWDMOZSFV-UHFFFAOYSA-N
XLogP3.90
TPSA70.54 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.65
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2,6-Dimethoxypyrimidine-4-carboxylic acid
CID 2736210
Methyl 2,6-dimethoxypyrimidine-4-carboxylate
CID 330001
2-Chloro-6-methoxypyrimidine-4-carboxylate
CID 7282718
4-Pyrimidinecarboxylic acid, 2,6-bis[(tert-butyldimethylsilyl)oxy]-, tert-butyldimethylsilyl ester
CID 634925
Ethyl 2,6-dimethoxypyrimidine-4-carboxylate
CID 102390663
2,6-Bis[(trimethylsilyl)oxy]-4-pyrimidinecarbaldehyde
CID 553672
Methyl 6-methoxy-2-methylpyrimidine-4-carboxylate
CID 19018473
Methyl 2-amino-6-methoxypyrimidine-4-carboxylate
CID 22271472
6-Methoxy-2-vinyl-pyrimidine-4-carboxylic acid methyl ester
CID 67151586
Methyl 2-ethyl-6-methoxypyrimidine-4-carboxylate
CID 67151667
2,6-Dimethoxypyrimidine-4-carboxylic acid;hydrochloride
CID 70583126
2-(Ethylmethylamino)-6-methoxy-4-pyrimidinecarboxylic acid methyl ester
CID 122505466

Frequently Asked Questions

What is the IUPAC name of trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate?
The IUPAC name of trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate (CID 520508) is trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate.
What is the SMILES notation for trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate?
The canonical SMILES for trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate is C[Si](C)(C)OC(=O)c1cc(O[Si](C)(C)C)nc(O[Si](C)(C)C)n1.
What is the InChIKey of trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate?
The InChIKey is QOXWEKWDMOZSFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O4Si3/c1-21(2,3)18-12-10-11(13(17)19-22(4,5)6)15-14(16-12)20-23(7,8)9/h10H,1-9H3.
What are the key properties of trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate?
trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate has a molecular weight of 372.65 g/mol, XLogP of 3.90, 6 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylsilyl 2,6-bis(trimethylsilyloxy)pyrimidine-4-carboxylate is sourced from PubChem (CID 520508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).