Vitas-M small molecule compound

1-(4-nitrophenyl)cyclopentanecarboxylic acid

Catalog ID
STK179590
SMILES OC(=O)C1(CCCC1)c1ccc(cc1)[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 C12H13NO4 MW 235.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13NO4/c14-11(15)12(7-1-2-8-12)9-3-5-10(6-4-9)13(16)17/h3-6H,1-2,7-8H2,(H,14,15)
InChIKey
QDCPXRWNBXWBPZ-UHFFFAOYSA-N
Synonyms
52648-77-8
1(4NITROPHENYL)CYCLOPENTANE1CARBOXYLICACID
1(4NITROPHENYL)CYCLOPENTANECARBOXYLICACID
1(4NITROPHENYL)CYCLOPENTANOICACID
52648778
C1CCC(C1)(C2=CC=C(C=C2)(N+)(=O)(O))C(=O)O
CYCLOPENTANECARBOXYLICACID1(4NITROPHENYL)
InChI=1SC12H13NO4c1411(15)12(712812)93510(649)13(16)17h36H1278H2(H1415)
MFCD01012885
OC(=O)C1(CCCC1)c1ccc(cc1)(N+)(=O)(O)
ZINC000001512238
ZINC1512238

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Available files

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