Vitas-M small molecule compound

3-nitro-1-[(3s,5s,7s)-tricyclo[3.3.1.1~3,7~]dec-1-yl]-1H-1,2,4-triazol-5-ol

Catalog ID
STK641671
SMILES Oc1nc(nn1C12C[C@@H]3C[C@H](C2)C[C@H](C1)C3)[N+](=O)[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 C12H16N4O3 MW 264.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O3/c17-11-13-10(16(18)19)14-15(11)12-4-7-1-8(5-12)3-9(2-7)6-12/h7-9H,1-6H2,(H,13,14,17)/t7-,8+,9-,12?
InChIKey
DDXGYPTYMCUXQG-JHIQPEBDSA-N
Synonyms

3nitro1((3s5s7s)tricyclo(3311~37~)dec1yl)1H124triazol5ol
MFCD18162716
Oc1nc(nn1C12C(C@@H)3C(C@H)(C2)C(C@H)(C1)C3)(N+)(=O)(O)
ZINC000009142788

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Available files

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