Vitas-M small molecule compound
3-methoxy-3-(nitromethyl)-2-benzofuran-1(3H)-one
Catalog ID
STK675085
SMILES COC1(C[N+](=O)[O-])OC(=O)c2c1cccc2
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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 C10H9NO5 MW 223.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H9NO5/c1-15-10(6-11(13)14)8-5-3-2-4-7(8)9(12)16-10/h2-5H,6H2,1H3InChIKey
RSAZKHRUKRPGJB-UHFFFAOYSA-NSynonyms
54519-65-23methoxy3(nitromethyl)2benzofuran1(3H)one
3METHOXY3(NITROMETHYL)2BENZOFURAN1ONE
3METHOXY3(NITROMETHYL)3HYDROISOBENZOFURAN1ONE
3METHOXY3NITROMETHYLPHTHALIDE
54519652
COC1(C(N+)(=O)(O))OC(=O)c2c1cccc2
COC1(C2=CC=CC=C2C(=O)O1)C(N+)(=O)(O)
InChI=1SC10H9NO5c11510(611(13)14)853247(8)9(12)1610h25H6H21H3
MFCD01572546
ZINC000000077065
ZINC000000077068
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