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Specification
The molecular formula of Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate is C21H36N2O4.
Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate was created on August 9, 2005.
The molecular weight of Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate is 380.5 g/mol.
The IUPAC name of Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate is hexadecyl 2,4-dioxo-1H-pyrimidine-6-carboxylate.
The canonical SMILES representation of Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate is CCCCCCCCCCCCCCCCOC(=O)C1=CC(=O)NC(=O)N1.
The InChIKey of Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate is GKFRQFYVSXXTFY-UHFFFAOYSA-N.
Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate has 2 hydrogen bond donor counts.
The XLogP3-AA value of Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate is 6.8.
Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate has 17 rotatable bond counts.
Yes, Hexadecyl 1,2,3,6-tetrahydro-2,6-dioxopyrimidine-4-carboxylate is a canonicalized compound.
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