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2-Amino-5-bromobenzoic acid - 99%, high purity , CAS No.5794-88-7

1 Citations

COA

Grade & Purity:

≥99%

Cas Number: 5794-88-7
Molecular Weight: 216.03
Beilstein Registry Number: 639028
EC Number: 227-338-3
MDL number: MFCD00007823
PubChem CID: 79858
PubChem SID: 488185790

In stock

Item Number

A111259

Grouped product items
SKU	Size	Availability	Price
A111259-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$9.90
A111259-5g	5g	5	$22.90
A111259-25g	25g	3	$79.90
A111259-100g	100g	4	$223.90
A111259-500g	500g	1	$3,116.90

View related series

carboxylic acid (2098) Chemical Biology (1255) Peptide chemistry (314)

Basic Description

Synonyms	2-Amino-5-bromobenzoic acid \| Q27286937 \| A-5100 \| NSC 97201 \| Q30190723F \| SR-01000196285-1 \| 2-Amino-5-bromobenzoicacid \| Z104484428 \| 3414WR5FZI \| 5-bromo anthranilic acid \| SMR000371626 \| MFCD00007823 \| STK298440 \| AM84133 \| MLS002638148 \| UNII-Q30190
Specifications & Purity	≥99%
Shipped In	Normal
Product Description	It is used in the preparation of hepatitis C virus NS5b RNA polymerase inhibitors. Also used in the determination of cobalt, copper, nickel, and zinc.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives
      - Level5 Aminobenzoic acids and derivatives
        Level6 Aminobenzoic acids

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Aminobenzoic acids and derivatives
Direct Parent	Aminobenzoic acids
Alternative Parents	3-halobenzoic acids Halobenzoic acids Benzoic acids Benzoyl derivatives Aniline and substituted anilines Bromobenzenes Aryl bromides Vinylogous amides Amino acids Monocarboxylic acids and derivatives Carboxylic acids Organooxygen compounds Organobromides Organic oxides Hydrocarbon derivatives Primary amines Organopnictogen compounds
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aminobenzoic acid - Halobenzoic acid - 3-halobenzoic acid - Halobenzoic acid or derivatives - 3-halobenzoic acid or derivatives - Benzoic acid - Benzoyl - Aniline or substituted anilines - Bromobenzene - Halobenzene - Aryl bromide - Aryl halide - Vinylogous amide - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Primary amine - Amine - Organohalogen compound - Organobromide - Hydrocarbon derivative - Organonitrogen compound - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety.
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

Associated Targets(Human)

GLA Tclin Alpha-galactosidase A (5444 Activities)

Discover Target: GLA

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

GLP1R Tclin Glucagon-like peptide 1 receptor (111429 Activities)

Discover Target: GLP1R

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HEK293 (82097 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

HepG2 (196354 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

POLI Tchem DNA polymerase iota (116820 Activities)

Discover Target: POLI

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

EHMT2 Tchem Histone-lysine N-methyltransferase, H3 lysine-9 specific 3 (93046 Activities)

Discover Target: EHMT2

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

KDM4E Tchem Lysine-specific demethylase 4D-like (40243 Activities)

Discover Target: KDM4E

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Associated Targets(non-human)

Plasmodium falciparum (966862 Activities)

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Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Rorc Nuclear receptor ROR-gamma (89407 Activities)

Discover Target: Rorc

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

Pubchem Sid	488185790
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/488185790
IUPAC Name	2-amino-5-bromobenzoic acid
INCHI	InChI=1S/C7H6BrNO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,11)
InChIKey	CUKXRHLWPSBCTI-UHFFFAOYSA-N
Smiles	C1=CC(=C(C=C1Br)C(=O)O)N
Isomeric SMILES	C1=CC(=C(C=C1Br)C(=O)O)N
WGK Germany	3
RTECS	CB2557670
UN Number	2811
Molecular Weight	216.03
Beilstein	639028
Reaxy-Rn	639028
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=639028&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.

18 results found

Lot Number	Certificate Type	Date	Item
E2311054	Certificate of Analysis	Apr 18, 2025	A111259
G2419451	Certificate of Analysis	Jun 25, 2024	A111259
G2419374	Certificate of Analysis	Jun 25, 2024	A111259
G2419371	Certificate of Analysis	Jun 25, 2024	A111259
G2419373	Certificate of Analysis	Jun 25, 2024	A111259
G2419375	Certificate of Analysis	Jun 25, 2024	A111259
H1822135	Certificate of Analysis	Jan 15, 2024	A111259
A2402497	Certificate of Analysis	Nov 25, 2023	A111259
B2219404	Certificate of Analysis	Nov 16, 2023	A111259
B2219339	Certificate of Analysis	Nov 16, 2023	A111259
B1426032	Certificate of Analysis	Jul 13, 2023	A111259
G2117050	Certificate of Analysis	Apr 17, 2023	A111259
G2117052	Certificate of Analysis	Apr 17, 2023	A111259
B2325262	Certificate of Analysis	Mar 06, 2023	A111259
B2325260	Certificate of Analysis	Mar 03, 2023	A111259
B2325261	Certificate of Analysis	Mar 03, 2023	A111259
H1822136	Certificate of Analysis	Apr 26, 2022	A111259
B2219527	Certificate of Analysis	Jan 06, 2022	A111259

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Chemical and Physical Properties

Solubility	Soluble in methanol and dimethyl sulfoxide.
Sensitivity	Light sensitive.
Melt Point(°C)	213-215°C
Molecular Weight	216.030 g/mol
XLogP3	1.600
Hydrogen Bond Donor Count	2
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	1
Exact Mass	214.958 Da
Monoisotopic Mass	214.958 Da
Topological Polar Surface Area	63.300 Å²
Heavy Atom Count	11
Formal Charge	0
Complexity	163.000
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

Alternative Products

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Shuhua Cao, Xuezhao Li, Yong Gao, Fahui Li, Kaoxue Li, Xuanxuan Cao, Yiwen Dai, Lirong Mao, Shanshan Wang, Xishi Tai,. (2020-07-24) A simultaneously GSH-depleted bimetallic Cu(ii) complex for enhanced chemodynamic cancer therapy.. Dalton transactions (Cambridge, England : 2003), 49 ((34)): ( 11851-11858 ).

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2-Amino-5-bromobenzoic acid - 99%, high purity , CAS No.5794-88-7

Basic Description

Taxonomic Classification

Associated Targets(Human)

Associated Targets(non-human)

Mechanisms of Action

Names and Identifiers

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

Show more⌵

Chemical and Physical Properties

Alternative Products

Citations of This Product

Solution Calculators

Molarity Calculator

Dilution Calculator

Reconstitution Calculator

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