Vitas-M small molecule compound

methyl 2,2,4-trichloro-4-(2-methyl-2H-tetrazol-5-yl)butanoate

Catalog ID
STK525623
SMILES COC(=O)C(CC(c1nnn(n1)C)Cl)(Cl)Cl

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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 C7H9Cl3N4O2 MW 287.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H9Cl3N4O2/c1-14-12-5(11-13-14)4(8)3-7(9,10)6(15)16-2/h4H,3H2,1-2H3
InChIKey
WFBCVRCSXRZSQP-UHFFFAOYSA-N
Synonyms
136178-62-6
136178626
CN1N=C(N=N1)C(CC(C(=O)OC)(Cl)Cl)Cl
InChI=1SC7H9Cl3N4O2c114125(111314)4(8)37(910)6(15)162h4H3H212H3
methyl224trichloro4(2methyl2Htetrazol5yl)butanoate
METHYL224TRICHLORO4(2METHYLTETRAZOL5YL)BUTANOATE
MFCD01554805
ZINC000002306099
ZINC000002306100

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Available files

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