Vitas-M small molecule compound
methyl 3,5-dinitro-4-(pyrrolidin-1-yl)benzoate
Catalog ID
STK387433
SMILES COC(=O)c1cc([N+](=O)[O-])c(c(c1)[N+](=O)[O-])N1CCCC1
Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.
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 C12H13N3O6 MW 295.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13N3O6/c1-21-12(16)8-6-9(14(17)18)11(10(7-8)15(19)20)13-4-2-3-5-13/h6-7H,2-5H2,1H3InChIKey
YHRDIKPYHUUREV-UHFFFAOYSA-NSynonyms
35DINITRO4PYRROLIDIN1YLBENZOICACIDMETHYLESTER
COC(=O)C1=CC(=C(C(=C1)(N+)(=O)(O))N2CCCC2)(N+)(=O)(O)
COC(=O)c1cc((N+)(=O)(O))c(c(c1)(N+)(=O)(O))N1CCCC1
InChI=1SC12H13N3O6c12112(16)869(14(17)18)11(10(78)15(19)20)13423513h67H25H21H3
METHYL35DINITRO4(PYRROLIDIN1YL)BENZOATE
METHYL35DINITRO4PYRROLIDIN1YLBENZOATE
METHYL35DINITRO4PYRROLIDINYLBENZOATE
MFCD00413718
ZINC000004018204
ZINC04018204
ZINC4018204
Check stock
See real-time availability and sample size for STK387433 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.