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ALD00106

5-Methoxycarbonyl-1,2,3-triazine

Synonym(s):

1,2,3-Triazine-5-carboxylic acid, methyl ester

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About This Item

Empirical Formula (Hill Notation):
C5H5N3O2
CAS Number:
150017-40-6
Molecular Weight:
139.11
NACRES:
NA.22
PubChem Substance ID:
329772591
UNSPSC Code:
12352100
MDL number:
MFCD13195446
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form

powder

storage temp.

−20°C

SMILES string

O=C(OC)C1=CN=NN=C1

InChI

1S/C5H5N3O2/c1-10-5(9)4-2-6-8-7-3-4/h2-3H,1H3

InChI key

DZONTPIFZFRSGP-UHFFFAOYSA-N

Application

1,2,3-Triazines have been shown to be reactive substrates in inverse electron demand Diels-Alder strategies. Recent examples by the Boger Research Group have utilized this reactive motif in the construction of highly functionalized N-containing heterocycles.

Other Notes

Inverse Electron Demand Diels–Alder Reactions of 1, 2, 3-Triazines: Pronounced Substituent Effects on Reactivity and Cycloaddition Scope
Total Syntheses of (-)-Pyrimidoblamic Acid and P-3A

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

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