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N-(2-Carboxyethyl)iminodiacetic Acid - >98.0%(T), high purity , CAS No.6245-75-6

COA

Grade & Purity:

≥98%(T)

Cas Number: 6245-75-6
Molecular Weight: 205.17
MDL number: MFCD00059634
PubChem CID: 535795

In stock

Item Number

N159332

Grouped product items
SKU	Size	Availability	Price
N159332-1g	1g	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$15.90
N159332-5g	5g	10	$59.90
N159332-25g	25g	8	$163.90

View related series

Carbonyl compound (2335) carboxylic acid (2098)

Basic Description

Synonyms	Q17128124 \| 3-(BIS(CARBOXYMETHYL)AMINO)PROPIONIC ACID \| Nitrilodiacetic-propionic Acid \| 2,2 inverted exclamation mark -[(2-Carboxyethyl)azanediyl]diacetic Acid \| BETA-ALANINE DIACETIC ACID [INCI] \| EINECS 228-360-6 \| MFCD00059634 \| N0408 \| BS-49239 \| UNI
Specifications & Purity	≥98%(T)
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organic acids and derivatives
  - Class Carboxylic acids and derivatives
    - Subclass Amino acids, peptides, and analogues
      - Level5 Amino acids and derivatives
        Level6 Alpha amino acids and derivatives
        Level7 Alpha amino acids

Kingdom	Organic compounds
Superclass	Organic acids and derivatives
Class	Carboxylic acids and derivatives
Subclass	Amino acids, peptides, and analogues
Intermediate Tree Nodes	Amino acids and derivatives - Alpha amino acids and derivatives
Direct Parent	Alpha amino acids
Alternative Parents	Tricarboxylic acids and derivatives Trialkylamines Amino acids Carboxylic acids Organopnictogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
Molecular Framework	Aliphatic acyclic compounds
Substituents	Alpha-amino acid - Tricarboxylic acid or derivatives - Tertiary amine - Tertiary aliphatic amine - Amino acid - Carboxylic acid - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Amine - Organic nitrogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
Description	This compound belongs to the class of organic compounds known as alpha amino acids. These are amino acids in which the amino group is attached to the carbon atom immediately adjacent to the carboxylate group (alpha carbon).
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

IUPAC Name	3-[bis(carboxymethyl)amino]propanoic acid
INCHI	InChI=1S/C7H11NO6/c9-5(10)1-2-8(3-6(11)12)4-7(13)14/h1-4H2,(H,9,10)(H,11,12)(H,13,14)
InChIKey	UWRBFYBQPCJRRL-UHFFFAOYSA-N
Smiles	C(CN(CC(=O)O)CC(=O)O)C(=O)O
Isomeric SMILES	C(CN(CC(=O)O)CC(=O)O)C(=O)O
Molecular Weight	205.17
Reaxy-Rn	1712227
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1712227&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.

3 results found

Lot Number	Certificate Type	Date	Item
I2202037	Certificate of Analysis	Sep 06, 2022	N159332
I2202038	Certificate of Analysis	Sep 06, 2022	N159332
I2202036	Certificate of Analysis	Sep 06, 2022	N159332

Chemical and Physical Properties

Melt Point(°C)	195 °C
Molecular Weight	205.170 g/mol
XLogP3	-3.300
Hydrogen Bond Donor Count	3
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	7
Exact Mass	205.059 Da
Monoisotopic Mass	205.059 Da
Topological Polar Surface Area	115.000 Å²
Heavy Atom Count	14
Formal Charge	0
Complexity	222.000
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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