Vitas-M small molecule compound
methyl 3-[(4-chloro-3-nitro-1H-pyrazol-1-yl)methyl]benzoate
Catalog ID
STK348757
SMILES COC(=O)c1cccc(c1)Cn1cc(c(n1)[N+](=O)[O-])Cl
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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 C12H10ClN3O4 MW 295.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10ClN3O4/c1-20-12(17)9-4-2-3-8(5-9)6-15-7-10(13)11(14-15)16(18)19/h2-5,7H,6H2,1H3InChIKey
BAAFVWNLIUBTNG-UHFFFAOYSA-NSynonyms
1002535-22-91002535229
3(4CHLORO3NITROPYRAZOL1YLMETHYL)BENZOICACIDMETHYLESTER
COC(=O)C1=CC(=CC=C1)CN2C=C(C(=N2)(N+)(=O)(O))Cl
COC(=O)c1cccc(c1)Cn1cc(c(n1)(N+)(=O)(O))Cl
InChI=1SC12H10ClN3O4c12012(17)94238(59)615710(13)11(1415)16(18)19h257H6H21H3
methyl3((4chloro3nitro1Hpyrazol1yl)methyl)benzoate
METHYL3((4CHLORO3NITROPYRAZOL1YL)METHYL)BENZOATE
METHYL3((4CHLORO3NITROPYRAZOLYL)METHYL)BENZOATE
MFCD02253857
ZINC000004294274
ZINC04294274
ZINC4294274
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