4-Hydroxy-3-nitrobenzoic acid - ≥98% , CAS No.616-82-0

CAS: 616-82-0 Cat. No.: H102134 Formula: C7H5NO5 Peso molecolare: 183.12 Beilstein Registry Number: 2213134 Numero EC: 210-494-1
Disponibile su ordine
GRADE & PURITY ≥98%
Synonyms
Benzoic acid, 4-hydroxy-3-nitro- | Z385458396 | DTXSID20210609 | AKOS003382446 | 3-Nitro-4-hydroxybenzoic acid | AM20040866 | 3,4-Nitrohydroxybenzoic acid | 3-Nitro-4-hydrobenzoic acid | UNII-8SL84Q8B6C | QRYSWXFQLFLJTC-UHFFFAOYSA- | SCHEMBL106249 | NSC 7
Storage
Room temperature
Shipped In
Normal
★
Size
Germania (EU)
USA*
Price
Qty
25g
H102134-25g
—
3 Disponibile

19,87€

30,28€
Salva 10,41 € (34.38%)
100g
H102134-100g
—
2 Disponibile

37,23€

56,32€
Salva 19,09 € (33.90%)
500g
H102134-500g
—
1 Disponibile

183,87€

275,85€
Salva 91,98 € (33.34%)
Enter a quantity for the sizes you want to add.
🧪

Why this grade

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

🌡

Storage & shipping

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

📋

Quality documents

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

📚

Literature proof

Cited in 2 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Panoramica

4-Hydroxy-3-nitrobenzoic acid was coupled to ionic liquid-immobilized o-phenylenediamine to form benzimidazole derivatives

Specifications

Sinonimi
Benzoic acid, 4-hydroxy-3-nitro- | Z385458396 | DTXSID20210609 | AKOS003382446 | 3-Nitro-4-hydroxybenzoic acid | AM20040866 | 3,4-Nitrohydroxybenzoic acid | 3-Nitro-4-hydrobenzoic acid | UNII-8SL84Q8B6C | QRYSWXFQLFLJTC-UHFFFAOYSA- | SCHEMBL106249 | NSC 7
Specifiche e purezza
≥98%
Condizioni di conservazione di stoccaggio
Room temperature
Spedito in
Normal
Purezza
≥98%
Nomi e identificatori
Pubchem Sid488181516
Pubchem Sid Urlhttps://pubchem.ncbi.nlm.nih.gov/substance/488181516
Sorrisi canoniciC1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])O
IUPAC Name4-hydroxy-3-nitrobenzoic acid
InChIKeyQRYSWXFQLFLJTC-UHFFFAOYSA-N
INCHI1S/C7H5NO5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9H,(H,10,11)
Isomeri SMILES C1=CC(=C(C=C1C(=O)O)[N+](=O)[O-])O
WGK Germania 3
Peso molecolare 183.12
Beilstein 2213134
Reaxy-Rn 2213134
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2213134&ln=

Documentazione

📋 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
ClasseBenzene and substituted derivatives
SubclassBenzoic acids and derivatives
Intermediate Tree Nodes Not available
Direct ParentNitrobenzoic acids and derivatives
Alternative Parents Nitrophenols  Hydroxybenzoic acid derivatives  Benzoic acids  Nitrobenzenes  Benzoyl derivatives  Nitroaromatic compounds  1-hydroxy-2-unsubstituted benzenoids  Propargyl-type 1,3-dipolar organic compounds  Organic oxoazanium compounds  Carboxylic acids  Monocarboxylic acids and derivatives  Hydrocarbon derivatives  Organic oxides  Organonitrogen compounds  Organooxygen compounds  Organopnictogen compounds  
Molecular FrameworkAromatic homomonocyclic compounds
Substituents Nitrobenzoate - Hydroxybenzoic acid - Nitrophenol - Benzoic acid - Nitrobenzene - Nitroaromatic compound - Benzoyl - 1-hydroxy-2-unsubstituted benzenoid - Phenol - Organic nitro compound - C-nitro compound - Allyl-type 1,3-dipolar organic compound - Monocarboxylic acid or derivatives - Propargyl-type 1,3-dipolar organic compound - Organic oxoazanium - Organic 1,3-dipolar compound - Carboxylic acid - Carboxylic acid derivative - Organic nitrogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound
DescrizioneThis 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 Not available
Struttura 3D
Modello di struttura chimica interattiva





Certificati (CoA, COO, BSE/TSE e tabella di analisi)
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.

9 results found

Lot NumberCertificate TypeDataOggetto
I2220131Certificate of AnalysisJul 06, 2026 H102134
I2101233Certificate of AnalysisJun 11, 2025 H102134
I2101234Certificate of AnalysisJun 11, 2025 H102134
H1223006Certificate of AnalysisJan 21, 2025 H102134
E2326710Certificate of AnalysisApr 21, 2023 H102134
E2326714Certificate of AnalysisApr 21, 2023 H102134
E2326716Certificate of AnalysisApr 21, 2023 H102134
E2326717Certificate of AnalysisApr 21, 2023 H102134
E2326891Certificate of AnalysisApr 21, 2023 H102134
Proprietà chimiche e fisiche
Punto di fusione (°C)183-186°C
Peso molecolare183.120 g/mol
XLogP32.000
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count1
Exact Mass183.017 Da
Monoisotopic Mass183.017 Da
Topological Polar Surface Area103.000 Ų
Heavy Atom Count13
Formal Charge0
Complexity223.000
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
Riferimenti
1. Xu Gao, Qi Zhang, Ziyi Yang, Yuefei Ji, Jing Chen, Junhe Lu.  (2022)  Formation of Nitrophenolic Byproducts during UV-Activated Peroxydisulfate Oxidation in the Presence of Nitrate.  ACS ES&T Engineering,      [PMID:] [10.1021/acsestengg.1c00356]
2. Peizeng Yang, Li Qian, Yan Cheng, Yuefei Ji, Junhe Lu, Deyang Kong.  (2020)  Formation of nitrophenolic byproducts in soils subjected to sulfate radical oxidation.  CHEMICAL ENGINEERING JOURNAL,      [PMID:] [10.1016/j.cej.2020.126316]
Calcolatori di soluzioni
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