Vitas-M small molecule compound
methyl 2-{[bis(3-nitrophenyl)phosphoryl]oxy}benzoate
Catalog ID
STK962617
SMILES COC(=O)c1ccccc1OP(=O)(c1cccc(c1)[N+](=O)[O-])c1cccc(c1)[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 C20H15N2O8P MW 442.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15N2O8P/c1-29-20(23)18-10-2-3-11-19(18)30-31(28,16-8-4-6-14(12-16)21(24)25)17-9-5-7-15(13-17)22(26)27/h2-13H,1H3InChIKey
KVJKZXCBRVYMLZ-UHFFFAOYSA-NSynonyms
380906-12-72(BIS(3NITROPHENYL)PHOSPHINOYLOXY)BENZOICACIDMETHYLESTER
380906127
COC(=O)C1=CC=CC=C1OP(=O)(C2=CC=CC(=C2)(N+)(=O)(O))C3=CC=CC(=C3)(N+)(=O)(O)
COC(=O)c1ccccc1OP(=O)(c1cccc(c1)(N+)(=O)(O))c1cccc(c1)(N+)(=O)(O)
InChI=1SC20H15N2O8Pc12920(23)1810231119(18)3031(281684614(1216)21(24)25)1795715(1317)22(26)27h213H1H3
methyl2((bis(3nitrophenyl)phosphoryl)oxy)benzoate
METHYL2(BIS(3NITROPHENYL)CARBONYLOXY)BENZOATE
METHYL2BIS(3NITROPHENYL)PHOSPHORYLOXYBENZOATE
MFCD02608996
ZINC000002303533
ZINC2303533
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