Vitas-M small molecule compound

1-ethynyl-2-nitrobenzene

Catalog ID
STL438106
SMILES C#Cc1ccccc1[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 C8H5NO2 MW 147.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C8H5NO2/c1-2-7-5-3-4-6-8(7)9(10)11/h1,3-6H
InChIKey
FWAGYANFBMIHFQ-UHFFFAOYSA-N
Synonyms
16433-96-8
16433968
1ethynyl2nitrobenzene
2NITROPHENYLACETYLENE
2NITROPHENYLACETYLENE97
BENZENE1ETHYNYL2NITRO
C#CC1=CC=CC=C1(N+)(=O)(O)
C#Cc1ccccc1(N+)(=O)(O)
InChI=1SC8H5NO2c12753468(7)9(10)11h136H
MFCD01113917
ZINC000001410225
ZINC01410225
ZINC1410225

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Available files

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