Vitas-M small molecule compound

2,2'-[(4-amino-5-nitropyrimidin-2-yl)imino]diethanol

Catalog ID
STL243165
SMILES OCCN(c1ncc(c(n1)N)[N+](=O)[O-])CCO

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C8H13N5O4 MW 243.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H13N5O4/c9-7-6(13(16)17)5-10-8(11-7)12(1-3-14)2-4-15/h5,14-15H,1-4H2,(H2,9,10,11)
InChIKey
CMHAOQKSMWCMMH-UHFFFAOYSA-N
Synonyms
1324098-57-8
1324098578
2((4amino5nitropyrimidin2yl)(2hydroxyethyl)amino)ethanol
22((4amino5nitropyrimidin2yl)azanediyl)diethanol
22((4amino5nitropyrimidin2yl)imino)diethanol
C1=C(C(=NC(=N1)N(CCO)CCO)N)(N+)(=O)(O)
InChI=1SC8H13N5O4c976(13(16)17)5108(117)12(1314)2415h51415H14H2(H291011)
MFCD19712412
OCCN(c1ncc(c(n1)N)(N+)(=O)(O))CCO
ZINC000071286684
ZINC71286684

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.