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5-Hydroxy-2-nitrobenzoic Acid - ≥98.0%(GC), high purity , CAS No.610-37-7

COA

Grade & Purity:

≥98%(GC)

Cas Number: 610-37-7
Molecular Weight: 183.12
Beilstein Registry Number: 10(4)338
MDL number: MFCD00017566
PubChem CID: 11882
PubChem SID: 504752214

In stock

Item Number

H133944

Grouped product items
SKU	Size	Availability	Price
H133944-1g	1g	5	$19.90
H133944-5g	5g	1	$74.90
H133944-25g	25g	6	$217.90
H133944-100g	100g	5	$783.90

View related series

Nitrogenous compounds (2445) Non heterocyclic block (8163)

Basic Description

Synonyms	AKOS009157631 \| 3-carboxy-4-nitrophenol;2-Nitro-5-hydroxybenzoic acid \| 5-Hydroxy-2-Nitro Benzoic Acid \| AMY28119 \| AC-3262 \| doi:10.14272/BUHKQTKKZAXSMH-UHFFFAOYSA-N.1 \| A20360 \| AO-801/41077445 \| BRN 2107504 \| EN300-116557 \| H1321 \| MFCD00017566 \| AS-15
Specifications & Purity	≥98%(GC)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Not available
Direct Parent	Nitrobenzoic 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 Framework	Aromatic 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
Description	This 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
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

Pubchem Sid	504752214
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504752214
IUPAC Name	5-hydroxy-2-nitrobenzoic acid
INCHI	InChI=1S/C7H5NO5/c9-4-1-2-6(8(12)13)5(3-4)7(10)11/h1-3,9H,(H,10,11)
InChIKey	BUHKQTKKZAXSMH-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1O)C(=O)O)[N+](=O)[O-]
Isomeric SMILES	C1=CC(=C(C=C1O)C(=O)O)[N+](=O)[O-]
RTECS	DH2528250
Molecular Weight	183.12
Beilstein	10(4)338
Reaxy-Rn	2107504
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2107504&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

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.

5 results found

Lot Number	Certificate Type	Date	Item
F2223183	Certificate of Analysis	Apr 03, 2024	H133944
F2223245	Certificate of Analysis	Apr 03, 2024	H133944
K1624048	Certificate of Analysis	Jun 17, 2022	H133944
G2320092	Certificate of Analysis	Jun 17, 2022	H133944
A2226079	Certificate of Analysis	Feb 11, 2022	H133944

Chemical and Physical Properties

Melt Point(°C)	170 °C
Molecular Weight	183.120 g/mol
XLogP3	1.100
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	1
Exact Mass	183.017 Da
Monoisotopic Mass	183.017 Da
Topological Polar Surface Area	103.000 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	223.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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