Vitas-M small molecule compound

2-(butylamino)-2-oxoethyl 2-bromobenzoate

Catalog ID
STL186315
SMILES CCCCNC(=O)COC(=O)c1ccccc1Br

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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 C13H16BrNO3 MW 314.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16BrNO3/c1-2-3-8-15-12(16)9-18-13(17)10-6-4-5-7-11(10)14/h4-7H,2-3,8-9H2,1H3,(H,15,16)
InChIKey
WQVVBZOSFOVGCA-UHFFFAOYSA-N
Synonyms

(2(butylamino)2oxoethyl)2bromobenzoate
2(butylamino)2oxoethyl2bromobenzoate
CCCCNC(=O)COC(=O)C1=CC=CC=C1Br
InChI=1SC13H16BrNO3c12381512(16)91813(17)10645711(10)14h47H2389H21H3(H1516)
MFCD22387722
ZINC000061578977
ZINC61578977

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Available files

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