Vitas-M small molecule compound

[4-iodo-1-(2-methylpropyl)-1H-pyrazol-3-yl]acetic acid

Catalog ID
STL415403
SMILES CC(Cn1cc(c(n1)CC(=O)O)I)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 C9H13IN2O2 MW 308.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H13IN2O2/c1-6(2)4-12-5-7(10)8(11-12)3-9(13)14/h5-6H,3-4H2,1-2H3,(H,13,14)
InChIKey
ISZMKMPSDQSJHF-UHFFFAOYSA-N
Synonyms
1798775-86-6
(4iodo1(2methylpropyl)1Hpyrazol3yl)aceticacid
1798775866
2(4iodo1(2methylpropyl)pyrazol3yl)aceticacid
CC(C)CN1C=C(C(=N1)CC(=O)O)I
InChI=1SC9H13IN2O2c16(2)41257(10)8(1112)39(13)14h56H34H212H3(H1314)
MFCD28962891
ZINC000223249836
ZINC223249836

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Available files

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