Vitas-M small molecule compound

3,4-dihydroxy-5-nitrobenzaldehyde

Catalog ID
STL433372
SMILES O=Cc1cc(O)c(c(c1)[N+](=O)[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 C7H5NO5 MW 183.12 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H5NO5/c9-3-4-1-5(8(12)13)7(11)6(10)2-4/h1-3,10-11H
InChIKey
BBFJODMCHICIAA-UHFFFAOYSA-N
Synonyms
116313-85-0
116313850
34DIHYDROXY5NITROBENZAIDEHYDE
34DIHYDROXY5NITROBENZALDEHDYE
34dihydroxy5nitrobenzaldehyde
34DIHYDROXY5NITROBENZALDEHYDE(RAT)
3NITRO45DIHYDROXYBENZALDEHYDE
BENZALDEHYDE34DIHYDROXY5NITRO
C1=C(C=C(C(=C1(N+)(=O)(O))O)O)C=O
InChI=1SC7H5NO5c93415(8(12)13)7(11)6(10)24h131011H
MFCD00871897
O=Cc1cc(O)c(c(c1)(N+)(=O)(O))O
ZINC000000002779
ZINC2779

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Available files

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