N-methyliminodiacetic acid

IUPAC: 2-[carboxymethyl(methyl)amino]acetic acid

CAS 4408-64-4
C5H9NO4

N-methyliminodiacetic acid (CAS 4408-64-4) is a chemical compound with molecular formula C5H9NO4 and molecular weight 147.13 g/mol . GHS signal word: Warning. Hazard classifications: Health Hazard.

What is N-methyliminodiacetic acid?

Molecular Formula
C5H9NO4
Molecular Weight
147.13 g/mol

Structure Identifiers

SMILES
CN(CC(=O)O)CC(=O)O
InChI
InChI=1S/C5H9NO4/c1-6(2-4(7)8)3-5(9)10/h2-3H2,1H3,(H,7,8)(H,9,10)
InChIKey
XWSGEVNYFYKXCP-UHFFFAOYSA-N

Properties

Computed

Calculated molecular descriptors used in drug design and computational chemistry.

Exact Mass
147.0532 Da
XLogP
-3.30
TPSA
77.8 Ų
H-Bond Donors
2
H-Bond Acceptors
5
Complexity
129
Formal Charge
0

Safety information

Signal Word

Warning

GHS Pictograms

GHS pictogram: Health Hazard GHS07

Hazard Statements

  • H315 Causes skin irritation

Precautionary Statements

  • P261 Avoid breathing dust/fume/gas/mist/vapours/spray
  • P264 Wash thoroughly after handling
  • P271 Use only outdoors or in a well-ventilated area
  • P280 Wear protective gloves/protective clothing/eye protection/face protection
  • P302+P352 IF ON SKIN: Wash with soap and water
  • P304+P340 IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing
  • P305+P351+P338 IF IN EYES: Rinse continuously with water for several minutes. Remove contact lenses if present and easy to do, continue rinsing
  • P321 Specific treatment (see supplemental first aid instructions on this label)
  • P403+P233 Store in a well-ventilated place. Keep container tightly closed
  • P405 Store locked up
  • P501 Dispose of contents/container to an approved waste disposal plant

Synonyms (55)

  • MIDA
  • M2090
  • F066640
  • FM60840
  • AS-11328
  • NCI11773
  • NSC11773
  • SY011911
  • 4408-64-4
  • CCG-37638
  • DB-001063
  • NSC 11773
  • NSC-11773
  • SBB053605
  • CS-W007872
  • HY-W007872
  • NS00031390
  • orb2940340
  • SH1YP5H4NA
  • Z119894774
  • EN300-21786
  • MIDA ligand
  • MFCD00004284
  • NCGC00013126
  • NCI60_000423
  • SCHEMBL22061
  • AKOS001187242
  • CHEMBL1741474
  • DTXCID10118524
  • DTXSID00196033
  • RefChem:830727
  • SCHEMBL3898234
  • SCHEMBL5884556
  • NCGC00013126-02
  • NCGC00096247-01
  • UNII-SH1YP5H4NA
  • EINECS 224-557-6
  • NCIStruc1_001758
  • NCIStruc2_000172
  • Methylimidodiacetic acid
  • Methyliminodiacetic acid
  • (Methylimino)diacetic acid
  • N-METHYLIMINODIACETIC ACID
  • Acetic acid, (methylimino)di-
  • Methyliminodiacetic acid, 99%
  • 3-Azapentanedioic acid, 3-methyl-
  • N-(carboxymethyl)-N-methylGlycine
  • 2,2'-(methylazanediyl)diacetic acid
  • Glycine, N-(carboxymethyl)-N-methyl-
  • [(Carboxymethyl)(methyl)amino]acetic acid
Show 5 more names
  • 2-[(carboxymethyl)methylamino]acetic acid
  • 2-[carboxymethyl(methyl)amino]acetic acid
  • 2-[(carboxymethyl)(methyl)amino]acetic acid
  • 2-[carboxymethyl(methyl)amino]essigsäure
  • QuadraPure(R) IDA, macroporous, 350-750 mum particle size

Frequently asked questions

What is the CAS number of N-methyliminodiacetic acid?

The CAS Registry Number for N-methyliminodiacetic acid is 4408-64-4.

What is the IUPAC name of N-methyliminodiacetic acid?

The IUPAC name of N-methyliminodiacetic acid is 2-[carboxymethyl(methyl)amino]acetic acid.

What is the molecular formula of N-methyliminodiacetic acid?

N-methyliminodiacetic acid has the molecular formula C5H9NO4 and a molecular weight of 147.13 g/mol.

What is the SMILES notation for N-methyliminodiacetic acid?

The SMILES notation for N-methyliminodiacetic acid is CN(CC(=O)O)CC(=O)O.

Is N-methyliminodiacetic acid hazardous?

N-methyliminodiacetic acid carries the following GHS hazard classifications: Health Hazard. Signal word: Warning.

What are other names for N-methyliminodiacetic acid?

N-methyliminodiacetic acid is also known as (Methylimino)diacetic acid, [(Carboxymethyl)(methyl)amino]acetic acid, 2-[(carboxymethyl)(methyl)amino]acetic acid, 2-[(carboxymethyl)methylamino]acetic acid, 2-[carboxymethyl(methyl)amino]acetic acid.

Data sourced from PubChem CID 20441. Last updated .

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