2-Nitrobenzoic acid - ≥98% , CAS No.552-16-9

CAS: 552-16-9 Cat. No.: N110569 Peso molecular: 167.12 Beilstein Registry Number: 1910632 Número EC: 209-004-9
Disponible para pedir
GRADE & PURITY ≥98%
Synonyms
Benzoic acid, o-nitro- | AKOS000119255 | SCHEMBL17461588 | Benzoic acid, 2-nitro- | DTXSID5025738 | S6S4653K7Z | DTXCID005738 | MFCD00007137 | o-Nitrobenzoic acid | F3096-1719 | NCGC00091364-01 | NCGC00091364-02 | Tox21_201020 | 2-Nitrobenzoic acid, 95%,
Storage
Room temperature
Shipped In
Normal
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Size
Estado
Price
Qty
10g
N110569-10g
2

9,90US$

14,90US$
Guardar 5,00 US$ (33.56%)
25g
N110569-25g
8

11,90US$

17,90US$
Guardar 6,00 US$ (33.52%)
100g
N110569-100g
10

26,90US$

40,90US$
Guardar 14,00 US$ (34.23%)
500g
N110569-500g
2

103,90US$

155,90US$
Guardar 52,00 US$ (33.35%)
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Why this grade

≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Normal Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 74 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Sinónimos
Benzoic acid, o-nitro- | AKOS000119255 | SCHEMBL17461588 | Benzoic acid, 2-nitro- | DTXSID5025738 | S6S4653K7Z | DTXCID005738 | MFCD00007137 | o-Nitrobenzoic acid | F3096-1719 | NCGC00091364-01 | NCGC00091364-02 | Tox21_201020 | 2-Nitrobenzoic acid, 95%,
Especificaciones y pureza
≥98%
Condiciones de almacenamiento de almacenamiento
Room temperature
Enviado en
Normal
Pureza
≥98%
Nombres e identificadores
Pubchem Sid488181254
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181254
Sonrisas canónicasC1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
IUPAC Name2-nitrobenzoic acid
InChIKeySLAMLWHELXOEJZ-UHFFFAOYSA-N
INCHI1S/C7H5NO4/c9-7(10)5-3-1-2-4-6(5)8(11)12/h1-4H,(H,9,10)
Isómeros SMILES C1=CC=C(C(=C1)C(=O)O)[N+](=O)[O-]
WGK Alemania 3
RTECS DH5050000
Peso molecular 167.12
Beilstein 1910632
Reaxy-Rn 1910632
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1910632&ln=

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

Look up COA →

📊 Datasheet

Quick-reference summary of product specifications and applications.

View datasheet →

🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

View spec sheet →

Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassBenzenoids
ClaseBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentNitrobenzoic acids and derivatives
Alternative Parents Nitrobenzenes  Benzoic acids  Nitroaromatic compounds  Benzoyl derivatives  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Monocarboxylic acids and derivatives  Carboxylic acids  Organopnictogen compounds  Organooxygen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Nitrobenzoate - Benzoic acid - Nitrobenzene - Nitroaromatic compound - Benzoyl - Organic nitro compound - C-nitro compound - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Organic 1,3-dipolar compound - Propargyl-type 1,3-dipolar organic compound - Allyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescripciónThis compound belongs to the class of organic compounds known as nitrobenzoic acids and derivatives. These are compounds containing a nitrobenzoic acid moiety, which consists of a benzene ring bearing both a carboxylic acid group and a nitro group on two different ring carbon atoms.
External Descriptors nitrobenzoic acid
Estructura 3D
Modelo de Estructura Química Interactiva





Objetivos asociados (humanos)
CXCL8 Tchem Interleukin-8 (642 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Objetivos asociados (no humanos)
Ppard Peroxisome proliferator-activated receptor delta (358 Activities)
Activity TypeRelationActivity valueUnitsAction TypeJournalPubMed IddoiAssay Aladdin ID
Mecanismos de acción
Certificados (CoA, COO, BSE/TSE y tabla de análisis)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

14 results found

Lot NumberCertificate TypeFechaArticulo
I2215379Certificate of AnalysisJun 15, 2026 N110569
I2215380Certificate of AnalysisJun 15, 2026 N110569
I2215381Certificate of AnalysisJun 15, 2026 N110569
D2620029Certificate of AnalysisApr 29, 2026 N110569
J2122580Certificate of AnalysisAug 11, 2025 N110569
J2122582Certificate of AnalysisAug 11, 2025 N110569
J2122589Certificate of AnalysisAug 11, 2025 N110569
I2412502Certificate of AnalysisJun 27, 2024 N110569
D2014123Certificate of AnalysisFeb 23, 2024 N110569
A2508150Certificate of AnalysisAug 03, 2022 N110569
B2521040Certificate of AnalysisAug 03, 2022 N110569
L2325015Certificate of AnalysisAug 03, 2022 N110569
D2321405Certificate of AnalysisJun 05, 2021 N110569
D2321412Certificate of AnalysisJun 05, 2021 N110569

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Propiedades químicas y físicas
SolubilidadSoluble in water.
SensibilidadMoisture sensitive.
Punto de fusión (°C)147-148°C
Peso molecular167.120 g/mol
XLogP31.500
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass167.022 Da
Monoisotopic Mass167.022 Da
Topological Polar Surface Area83.100 Ų
Heavy Atom Count12
Formal Charge0
Complexity198.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1
Citations of This Product
Referencias
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4. Yao-Yao Wang, Haiou Wang, Feng Zhou, Yulong Wu, Haile Ma, Ru Zhao, Jian He, Zhujun Gu.  (2023)  Effect of ultrasonic thawing temperature on the quality of quick-frozen small yellow croaker (Larimichthys polyactis) and its possible mechanisms.  LWT-FOOD SCIENCE AND TECHNOLOGY,      [PMID:] [10.1016/j.lwt.2023.114620]
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