Vitas-M small molecule compound
1-(butan-2-yl)-4-chloro-1H-pyrazole-3-carboxylic acid
Catalog ID
STL414491
SMILES CCC(n1cc(c(n1)C(=O)O)Cl)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 C8H11ClN2O2 MW 202.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H11ClN2O2/c1-3-5(2)11-4-6(9)7(10-11)8(12)13/h4-5H,3H2,1-2H3,(H,12,13)InChIKey
QXXQAXVEVDNYLN-UHFFFAOYSA-NSynonyms
1006451-29-11(butan2yl)4chloro1Hpyrazole3carboxylicacid
1006451291
1butan2yl4chloropyrazole3carboxylicacid
1SECBUTYL4CHLORO1HPYRAZOLE3CARBOXYLICACID
4CHLORO1(METHYLPROPYL)PYRAZOLE3CARBOXYLICACID
CCC(C)N1C=C(C(=N1)C(=O)O)Cl
InChI=1SC8H11ClN2O2c135(2)1146(9)7(1011)8(12)13h45H3H212H3(H1213)
MFCD06805224
ZINC000020313794
ZINC000020313798
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