Ethyl 3,4-dihydro-4-oxopyrrolo[1,2-d][1,3,4]triazine-6-carboxylate


Chemical Name: Ethyl 3,4-dihydro-4-oxopyrrolo[1,2-d][1,3,4]triazine-6-carboxylate
CAS Number: 869067-01-6
Product Number: AG00H2PD(AGN-PC-0WAD3R)
Synonyms:
MDL No:
Molecular Formula: C9H9N3O3
Molecular Weight: 207.1861

Identification/Properties


Computed Properties
Molecular Weight:
207.189g/mol
XLogP3:
0.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
207.064g/mol
Monoisotopic Mass:
207.064g/mol
Topological Polar Surface Area:
72.7A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
316
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H317
Precautionary Statements:
P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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