(4-AMino-1,2,3,6-tetrahydro-1-Methyl-d3-2,6-dioxo-5-pyriMidinyl)-carbaMic Acid Ethyl Ester
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(4-AMino-1,2,3,6-tetrahydro-1-Methyl-d3-2,6-dioxo-5-pyriMidinyl)-carbaMic Acid Ethyl Ester
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CAS No:
1794768-19-6
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Formula:
C8H9D3N4O4
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Chemical Name:
(4-AMino-1,2,3,6-tetrahydro-1-Methyl-d3-2,6-dioxo-5-pyriMidinyl)-carbaMic Acid Ethyl Ester
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Synonyms:
4-Amino-5-[(ethoxycarbonyl)amino]-1-methyl-d3 Uracil
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CAS No:
(4-AMino-1,2,3,6-tetrahydro-1-Methyl-d3-2,6-dioxo-5-pyriMidinyl)-carbaMic Acid Ethyl Ester Basic Attributes
231.223765334
231.105
(4-AMino-1,2,3,6-tetrahydro-1-Methyl-d3-2,6-dioxo-5-pyriMidinyl)-carbaMic Acid Ethyl Ester Use and Manufacturing
Intermediate in the preparation of caffeine metabolites.
Computed Properties
Molecular Weight:231.22
XLogP3:-1.1
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:231.10468511
Monoisotopic Mass:231.10468511
Topological Polar Surface Area:114
Heavy Atom Count:16
Complexity:376
Isotope Atom Count:3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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