Vitas-M small molecule compound

4-bromobenzyl pyrazine-2-carboxylate

Catalog ID
STK862672
SMILES Brc1ccc(cc1)COC(=O)c1cnccn1

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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 C12H9BrN2O2 MW 293.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9BrN2O2/c13-10-3-1-9(2-4-10)8-17-12(16)11-7-14-5-6-15-11/h1-7H,8H2
InChIKey
XGLPAGKYVICXSV-UHFFFAOYSA-N
Synonyms
516466-47-0
(4BROMOPHENYL)METHYLPYRAZINE2CARBOXYLATE
4BROMOBENZYL2PYRAZINECARBOXYLATE
4bromobenzylpyrazine2carboxylate
516466470
C1=CC(=CC=C1COC(=O)C2=NC=CN=C2)Br
InChI=1SC12H9BrN2O2c1310319(2410)81712(16)11714561511h17H8H2
MFCD03694093
PYRAZINE2CARBOXYLICACID4BROMOBENZYLESTER
ZINC000000469636
ZINC00469636
ZINC469636

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Available files

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