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Sigma-Aldrich

Sodium 3-nitrobenzoate

≥95.0% (HPLC)

Synonym(s):

3-Nitrobenzoic acid sodium salt

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About This Item

Linear Formula:
3-O2NC6H4CO2Na
CAS Number:
827-95-2
Molecular Weight:
189.10
Beilstein:
4166479
EC Number:
212-578-3
MDL number:
MFCD00051097
UNSPSC Code:
12352100
PubChem Substance ID:
57652348
NACRES:
NA.22

Assay

≥95.0% (HPLC)

form

solid

SMILES string

[Na+].[O-]C(=O)c1cccc(c1)[N+]([O-])=O

InChI

1S/C7H5NO4.Na/c9-7(10)5-2-1-3-6(4-5)8(11)12;/h1-4H,(H,9,10);/q;+1/p-1

InChI key

MUADFEZFSKAZLT-UHFFFAOYSA-M

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Application

Sodium 3-nitrobenzoate may be used in the synthesis of [Ni(cyclam)(3-nitrobenzoate)2] complex. [Cyclam = 1,4,8,11-tetraazacyclotetradecane]

Pictograms

FlameExclamation mark
GHS02,GHS07

Signal Word

Danger

Hazard Statements

H228,H315,H319,H335

Hazard Classifications

Eye Irrit. 2 - Flam. Sol. 1 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

4.1B - Flammable solid hazardous materials

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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Novel nickel cyclam complexes with potent antimicrobial and cytotoxic properties.
Al-Bari MAA
Journal of Applied Sciences Research, 3(11), 1251-1261 (2007)
Reproductive toxicology. m-Nitrobenzoic acid.
Environmental health perspectives, 105 Suppl 1, 325-326 (1997-02-01)
M Samsonowicz et al.
Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy, 82(1), 235-246 (2011-08-25)
The influence of beryllium, magnesium, calcium, strontium and barium cations on the electronic system of 3-nitrobenzoic acid was studied in comparison with studied earlier alkali metal ions. The vibrational FT-IR (in KBr and ATR techniques) and (1)H and (13)C NMR
Zhiqiang Hu et al.
Water research, 39(4), 710-720 (2005-02-15)
The physical and biochemical characteristics of the biomass in three lab-scale sequencing batch reactors (SBR) treating a synthetic wastewater at a 20-day target solids retention time (SRT) were investigated. The synthetic wastewater feed contained biogenic compounds and 22 organic priming
Miguel A Providenti et al.
Applied and environmental microbiology, 72(4), 2651-2660 (2006-04-07)
In Comamonas sp. strain JS46, 3-nitrobenzoate (3Nba) is initially oxidized at the 3,4 position by a dioxygenase, which results in release of nitrite and production of protocatechuate. The locus coding for the 3Nba dioxygenase (designated mnb, for m-nitrobenzoate) was mobilized
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