Vitas-M small molecule compound

N-(2-ethylphenyl)-5-nitropyrimidine-4,6-diamine

Catalog ID
STK944459
SMILES CCc1ccccc1Nc1ncnc(c1[N+](=O)[O-])N

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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 C12H13N5O2 MW 259.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N5O2/c1-2-8-5-3-4-6-9(8)16-12-10(17(18)19)11(13)14-7-15-12/h3-7H,2H2,1H3,(H3,13,14,15,16)
InChIKey
APNZQRYZKNDUJI-UHFFFAOYSA-N
Synonyms
450345-04-7
450345047
4N(2ETHYLPHENYL)5NITROPYRIMIDINE46DIAMINE
CCC1=CC=CC=C1NC2=NC=NC(=C2(N+)(=O)(O))N
CCc1ccccc1Nc1ncnc(c1(N+)(=O)(O))N
InChI=1SC12H13N5O2c12853469(8)161210(17(18)19)11(13)1471512h37H2H21H3(H313141516)
MFCD04453058
N(2ethylphenyl)5nitropyrimidine46diamine
N4(2ETHYLPHENYL)5NITROPYRIMIDINE46DIAMINE
ZINC000003912548
ZINC03912548
ZINC3912548

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Available files

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