Basic Description

Specifications & Purity	≥95%
Storage Temp	Store at 2-8°C
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives
      - Level5 Phthalic acid and derivatives
        Level6 M-phthalic acid and derivatives

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Phthalic acid and derivatives
Direct Parent	M-phthalic acid and derivatives
Alternative Parents	Aminobenzoic acids Benzoic acids Benzoyl derivatives Aniline and substituted anilines Dicarboxylic acids and derivatives Vinylogous amides Amino acids Carboxylic acids Primary amines Organopnictogen compounds Organooxygen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Meta_phthalic_acid - Aminobenzoic acid - Aminobenzoic acid or derivatives - Benzoic acid - Benzoyl - Aniline or substituted anilines - Dicarboxylic acid or derivatives - Vinylogous amide - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Carboxylic acid - Amine - Organonitrogen compound - Organooxygen compound - Primary amine - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as m-phthalic acid and derivatives. These are aromatic compounds containing a benzene ring bearing a carboxylic acid group at ring carbon atoms 1 and 2.
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	504758349
Pubchem Sid Url	https://pubchem.ncbi.nlm.nih.gov/substance/504758349
IUPAC Name	2-aminobenzene-1,3-dicarboxylic acid
INCHI	InChI=1S/C8H7NO4/c9-6-4(7(10)11)2-1-3-5(6)8(12)13/h1-3H,9H2,(H,10,11)(H,12,13)
InChIKey	LDOMKUVUXZRECL-UHFFFAOYSA-N
Smiles	C1=CC(=C(C(=C1)C(=O)O)N)C(=O)O
Isomeric SMILES	C1=CC(=C(C(=C1)C(=O)O)N)C(=O)O
Molecular Weight	181.15
Reaxy-Rn	2723553
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2723553&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.

6 results found

Lot Number	Certificate Type	Date	Item
K1821051	Certificate of Analysis	Jun 03, 2024	A193185
K1821031	Certificate of Analysis	Jun 03, 2024	A193185
J2213079	Certificate of Analysis	Aug 13, 2022	A193185
J2213098	Certificate of Analysis	Aug 13, 2022	A193185
J2213124	Certificate of Analysis	Aug 13, 2022	A193185
J2213080	Certificate of Analysis	Aug 13, 2022	A193185

Chemical and Physical Properties

Molecular Weight	181.150 g/mol
XLogP3	0.800
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	2
Exact Mass	181.038 Da
Monoisotopic Mass	181.038 Da
Topological Polar Surface Area	101.000 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	206.000
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

Citations of This Product

How to Cite Aladdin Scientific Products?

1. Noor Ul Afsar, Xiaolin Ge, Zhang Zhao, Arif Hussain, Yubin He, Liang Ge, Tongwen Xu. (2021) Zwitterion membranes for selective cation separation via electrodialysis. SEPARATION AND PURIFICATION TECHNOLOGY, 254 (117619).
2. Sheng Li, Wentong Fan, Qiulin Chen, Xinfeng Zhang. (2024) Facile Light-Driven Synthesis of Highly Luminous Sulfur Quantum Dots for Fluorescence Sensing and Cell Imaging. ACS Applied Materials & Interfaces, 16 (31): (41281-41292).

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SKU	Size	Availability	Price
A193185-1g	1g	3	$9.90
A193185-5g	5g	3	$20.90
A193185-10g	10g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$37.90
A193185-25g	25g	3	$88.90
A193185-100g	100g	3	$348.90

2-Aminoisophthalic Acid - 95%, high purity , CAS No.39622-79-2