Vitas-M small molecule compound
(2E)-3-[4-(2-ethoxy-2-oxoethoxy)-3-nitrophenyl]prop-2-enoic acid
Catalog ID
STK664899
SMILES CCOC(=O)COc1ccc(cc1[N+](=O)[O-])/C=C/C(=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 C13H13NO7 MW 295.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13NO7/c1-2-20-13(17)8-21-11-5-3-9(4-6-12(15)16)7-10(11)14(18)19/h3-7H,2,8H2,1H3,(H,15,16)/b6-4+InChIKey
BHXLLSVOHJUCBH-GQCTYLIASA-NSynonyms
893764-59-5(2E)3(4(2ETHOXY2OXOETHOXY)3NITROPHENYL)ACRYLICACID
(2E)3(4(2ethoxy2oxoethoxy)3nitrophenyl)prop2enoicacid
(E)3(4(2ETHOXY2OXOETHOXY)3NITROPHENYL)PROP2ENOICACID
893764595
CCOC(=O)COC1=C(C=C(C=C1)C=CC(=O)O)(N+)(=O)(O)
CCOC(=O)COc1ccc(cc1(N+)(=O)(O))C=CC(=O)O
InChI=1SC13H13NO7c122013(17)82111539(4612(15)16)710(11)14(18)19h37H28H21H3(H1516)b64+
MFCD07658071
ZINC000004779404
ZINC4779404
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