Vitas-M small molecule compound

2-(diphenylphosphoryl)-4-nitrophenyl acetate

Catalog ID
STL330629
SMILES CC(=O)Oc1ccc(cc1P(=O)(c1ccccc1)c1ccccc1)[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 C20H16NO5P MW 381.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16NO5P/c1-15(22)26-19-13-12-16(21(23)24)14-20(19)27(25,17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-14H,1H3
InChIKey
ZHUTXDSWQRKQQH-UHFFFAOYSA-N
Synonyms

(2DIPHENYLPHOSPHORYL4NITROPHENYL)ACETATE
2(diphenylphosphoryl)4nitrophenylacetate
CC(=O)OC1=C(C=C(C=C1)(N+)(=O)(O))P(=O)(C2=CC=CC=C2)C3=CC=CC=C3
CC(=O)Oc1ccc(cc1P(=O)(c1ccccc1)c1ccccc1)(N+)(=O)(O)
InChI=1SC20H16NO5Pc115(22)2619131216(21(23)24)1420(19)27(25178425917)18106371118h214H1H3
MFCD02997007
ZINC000097951206
ZINC97951206

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.