Vitas-M small molecule compound

1-[3-(propan-2-yl)-3,3a,4,5,6,7-hexahydro-2H-indazol-2-yl]ethanone

Catalog ID
STK056779
SMILES CC(C1N(N=C2C1CCCC2)C(=O)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 C12H20N2O MW 208.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H20N2O/c1-8(2)12-10-6-4-5-7-11(10)13-14(12)9(3)15/h8,10,12H,4-7H2,1-3H3
InChIKey
PUAQGLLTOYVTSQ-UHFFFAOYSA-N
Synonyms
313391-98-9
1(3(propan2yl)33a4567hexahydro2Hindazol2yl)ethanone
1(3isopropyl33a4567hexahydro2Hindazol2yl)ethanone
1(3propan2yl33a4567hexahydroindazol2yl)ethanone
313391989
CC(C)C1C2CCCCC2=NN1C(=O)C
CC(C1N(N=C2C1CCCC2)C(=O)C)C
InChI=1SC12H20N2Oc18(2)1210645711(10)1314(12)9(3)15h81012H47H213H3
MFCD01025661
STK056779
ZINC000000238674
ZINC000000238679

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Available files

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