Vitas-M small molecule compound
1-(4-bromobenzyl)-5-ethyl-1H-1,2,3-triazole-4-carboxylic acid
Catalog ID
STL166164
SMILES CCc1n(nnc1C(=O)O)Cc1ccc(cc1)Br
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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 C12H12BrN3O2 MW 310.15 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12BrN3O2/c1-2-10-11(12(17)18)14-15-16(10)7-8-3-5-9(13)6-4-8/h3-6H,2,7H2,1H3,(H,17,18)InChIKey
IJLUEXNXZHKSNF-UHFFFAOYSA-NSynonyms
1283434-04-71((4bromophenyl)methyl)5ethyltriazole4carboxylicacid
1(4bromobenzyl)5ethyl1H123triazole4carboxylicacid
1283434047
CCC1=C(N=NN1CC2=CC=C(C=C2)Br)C(=O)O
InChI=1SC12H12BrN3O2c121011(12(17)18)141516(10)78359(13)648h36H27H21H3(H1718)
MFCD17927440
ZINC000050214241
ZINC50214241
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