Vitas-M small molecule compound

2-chloro-5-nitro-N-(tetrahydrofuran-2-ylmethyl)pyrimidine-4,6-diamine

Catalog ID
STK558597
SMILES Clc1nc(NCC2CCCO2)c(c(n1)N)[N+](=O)[O-]

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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 C9H12ClN5O3 MW 273.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H12ClN5O3/c10-9-13-7(11)6(15(16)17)8(14-9)12-4-5-2-1-3-18-5/h5H,1-4H2,(H3,11,12,13,14)
InChIKey
GGBHPKCPKKGDIA-UHFFFAOYSA-N
Synonyms
587010-65-9
2CHLORO5NITRO4N(OXOLAN2YLMETHYL)PYRIMIDINE46DIAMINE
2chloro5nitroN(tetrahydrofuran2ylmethyl)pyrimidine46diamine
2chloro5nitroN4((tetrahydrofuran2yl)methyl)pyrimidine46diamine
587010659
C1CC(OC1)CNC2=NC(=NC(=C2(N+)(=O)(O))N)Cl
Clc1nc(NCC2CCCO2)c(c(n1)N)(N+)(=O)(O)
InChI=1SC9H12ClN5O3c109137(11)6(15(16)17)8(149)1245213185h5H14H2(H311121314)
MFCD03491692
ZINC000005119895
ZINC000005119898

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Available files

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