Vitas-M small molecule compound

1-(4-fluorobenzyl)-1H-1,2,3-triazole-4-carboxylic acid

Catalog ID
STL081040
SMILES Fc1ccc(cc1)Cn1nnc(c1)C(=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 C10H8FN3O2 MW 221.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H8FN3O2/c11-8-3-1-7(2-4-8)5-14-6-9(10(15)16)12-13-14/h1-4,6H,5H2,(H,15,16)
InChIKey
RMWPNKWXZUADBT-UHFFFAOYSA-N
Synonyms
889939-73-5
1((4FLUOROPHENYL)METHYL)1H123TRIAZOLE4CARBOXYLICACID
1((4fluorophenyl)methyl)triazole4carboxylicacid
1(4FLUOROBENZYL)1H(123)TRIAZOLE4CARBOXYLICACID
1(4fluorobenzyl)1H123triazole4carboxylicacid
889939735
C1=CC(=CC=C1CN2C=C(N=N2)C(=O)O)F
InChI=1SC10H8FN3O2c118317(248)51469(10(15)16)121314h146H5H2(H1516)
MFCD08445754
ZINC000013997987
ZINC13997987

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Available files

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