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137650

Sigma-Aldrich

6-Nitropiperonal

97%

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About This Item

Empirical Formula (Hill Notation):
C8H5NO5
CAS Number:
Molecular Weight:
195.13
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

97%

mp

93-94 °C (lit.)

SMILES string

[H]C(=O)c1cc2OCOc2cc1[N+]([O-])=O

InChI

1S/C8H5NO5/c10-3-5-1-7-8(14-4-13-7)2-6(5)9(11)12/h1-3H,4H2

InChI key

NRZWECORTTWSEF-UHFFFAOYSA-N

Application

6-Nitropiperonal was used to study the mechanism of aromatic nucleophilic substitution reaction of [18F]Fluoride ion. It was used in the synthesis of 6-[18F]fluoro-L-dopa.

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Flash Point(F)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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C Lemaire et al.
Journal of nuclear medicine : official publication, Society of Nuclear Medicine, 31(7), 1247-1251 (1990-07-01)
This paper describes the preparation of 6-[18F]fluoro-L-dopa by a no-carrier-added method based on the nucleophilic displacement of nitro groups of two commercially available substrates, 3,4-dimethoxy-2-nitrobenzaldehyde (nitroveratraldehyde) and 6-nitropiperonal. Fluorination was conducted in DMSO with fluorine-18 (18F) in the presence of
Can we predict reactivity for aromatic nucleophilic substitution with [18F] fluoride ion?
Rengan R, et al.
Journal of Labelled Compounds & Radiopharmaceuticals, 33(7), 563-572 (1993)

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