Vitas-M small molecule compound

methyl 5-(chloromethyl)-7-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidine-3-carboxylate

Catalog ID
STK787110
SMILES COC(=O)c1cnn2c1N=C(CCl)CC2=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 C9H8ClN3O3 MW 241.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H8ClN3O3/c1-16-9(15)6-4-11-13-7(14)2-5(3-10)12-8(6)13/h4H,2-3H2,1H3
InChIKey
RBONPUOKAWZDGV-UHFFFAOYSA-N
Synonyms
890096-11-4
890096114
COC(=O)C1=C2N=C(CC(=O)N2N=C1)CCl
InChI=1SC9H8ClN3O3c1169(15)6411137(14)25(310)128(6)13h4H23H21H3
methyl5(chloromethyl)7oxo67dihydropyrazolo(15a)pyrimidine3carboxylate
METHYL5(CHLOROMETHYL)7OXO68DIHYDROPYRAZOLO(15A)PYRIMIDINE3CARBOXYLATE
methyl5(chloromethyl)7oxo6Hpyrazolo(15a)pyrimidine3carboxylate
MFCD08445405
ZINC000012417890
ZINC12417890

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Available files

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