Vitas-M small molecule compound
pentyl 6-nitro-2-oxo-1,3-benzoxazole-3(2H)-carboxylate
Catalog ID
STK833669
SMILES CCCCCOC(=O)n1c(=O)oc2c1ccc(c2)[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 C13H14N2O6 MW 294.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H14N2O6/c1-2-3-4-7-20-12(16)14-10-6-5-9(15(18)19)8-11(10)21-13(14)17/h5-6,8H,2-4,7H2,1H3InChIKey
JNTAJDCLTLGLOZ-UHFFFAOYSA-NSynonyms
300705-39-9300705399
BENZOXAZOL3CARBOXYLICACID23DIHYDRO2OXO6NITROPENTYLESTER
CCCCCOC(=O)n1c(=O)oc2c1ccc(c2)(N+)(=O)(O)
CCCCCOC(=O)N1C2=C(C=C(C=C2)(N+)(=O)(O))OC1=O
InChI=1SC13H14N2O6c123472012(16)1410659(15(18)19)811(10)2113(14)17h568H247H21H3
MFCD00411881
pentyl6nitro2oxo13benzoxazole3(2H)carboxylate
PENTYL6NITRO2OXO13BENZOXAZOLE3CARBOXYLATE
pentyl6nitro2oxobenzo(d)oxazole3(2H)carboxylate
ZINC000002024262
ZINC02024262
ZINC2024262
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