Vitas-M small molecule compound

3-(2-nitrophenyl)prop-2-ynoic acid

Catalog ID
STK260095
SMILES OC(=O)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 C9H5NO4 MW 191.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C9H5NO4/c11-9(12)6-5-7-3-1-2-4-8(7)10(13)14/h1-4H,(H,11,12)
InChIKey
KVOGJHABINNFCY-UHFFFAOYSA-N
Synonyms
530-85-8
2NITROPHENYLPROPALICACID
2NITROPHENYLPROPIOLICACID
2NITROPHENYLPROPYNOICACID
2PROPYNOICACID3(2NITROPHENYL)
3(2NITROPHENYL)2PROPYNOICACID
3(2nitrophenyl)prop2ynoicacid
3(2NITROPHENYL)PROPIOLICACID
530858
C1=CC=C(C(=C1)C#CC(=O)O)(N+)(=O)(O)
InChI=1SC9H5NO4c119(12)65731248(7)10(13)14h14H(H1112)
MFCD01861406
OC(=O)C#Cc1ccccc1(N+)(=O)(O)
ONITROPHENYLPROPIOLICACID
PROPIOLICACID(ONITROPHENYL)
ZINC000001571077
ZINC1571077

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Available files

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