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Vitas-M small molecule compound

1-(1H-1,2,4-triazol-1-yl)propan-2-one

Catalog ID
STK787819
SMILES CC(=O)Cn1cncn1

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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 C5H7N3O MW 125.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C5H7N3O/c1-5(9)2-8-4-6-3-7-8/h3-4H,2H2,1H3
InChIKey
HBAZRGCNSUQWNN-UHFFFAOYSA-N
Synonyms
64882-52-6
1(124TRIAZOL1YL)PROPAN2ONE
1(124TRIAZOLYL)ACETONE
1(1H124TRIAZOL1YL)ACETONE
1(1H124TRIAZOL1YL)ACETONEHYDROCHLORIDE
1(1H124triazol1yl)propan2one
1(1H124TRIAZOLE1YL)ACETONE
2PROPANONE1(1H124TRIAZOL1YL)
64882526
CC(=O)CN1C=NC=N1
InChI=1SC5H7N3Oc15(9)2846378h34H2H21H3
MFCD08691415
ZINC000014987923
ZINC14987923

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Available files

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

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