Vitas-M small molecule compound
3-tert-butyl-4-chloro-1-methyl-1H-pyrazole-5-carboxylic acid
Catalog ID
STL315877
SMILES OC(=O)c1n(C)nc(c1Cl)C(C)(C)C
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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 C9H13ClN2O2 MW 216.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H13ClN2O2/c1-9(2,3)7-5(10)6(8(13)14)12(4)11-7/h1-4H3,(H,13,14)InChIKey
PWNMMQXAXFGQSW-UHFFFAOYSA-NSynonyms
685513-51-33(tertbutyl)4chloro1methyl1Hpyrazole5carboxylicacid
3tertbutyl4chloro1methyl1Hpyrazole5carboxylicacid
5TERTBUTYL4CHLORO2METHYL2HPYRAZOLE3CARBOXYLICACID
5tertbutyl4chloro2methylpyrazole3carboxylicacid
685513513
CC(C)(C)C1=NN(C(=C1Cl)C(=O)O)C
InChI=1SC9H13ClN2O2c19(23)75(10)6(8(13)14)12(4)117h14H3(H1314)
MFCD17194001
ZINC000084483490
ZINC84483490
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