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ChemicalBook--->CAS DataBase List--->13750-81-7

13750-81-7

13750-81-7 Structure

13750-81-7 Structure
IdentificationMore
[Name]

1-Methyl-2-imidazolecarboxaldehyde
[CAS]

13750-81-7
[Synonyms]

1-METHYL-1H-IMIDAZOLE-2-CARBALDEHYDE
1-METHYL-2-IMIDAZOLECARBOXALDEHYDE
1-METHYLIMIDAZOLE-2-CARBOXALDEHYDE
TIMTEC-BB SBB004338
Imidazole-2-carboxaldehyde, 1-methyl-
1-Methyl-1H-Imidazole-2-Carbal
1-METHYL-2-IMIDAZOLECARBOXALDEHYDE 98%
1-Methyl-1H-imidazole-2-carbaldehyde ,98%
[EINECS(EC#)]

627-478-9
[Molecular Formula]

C5H6N2O
[MDL Number]

MFCD01321308
[Molecular Weight]

110.11
[MOL File]

13750-81-7.mol
Chemical PropertiesBack Directory
[Appearance]

White to yellow crystalline mass,
[Melting point ]

36-39 °C (lit.)
[Boiling point ]

70-74 °C/1 mmHg (lit.)
[density ]

1.2111 (rough estimate)
[refractive index ]

1.5090 (estimate)
[Fp ]

215 °F
[storage temp. ]

under inert gas (nitrogen or Argon) at 2-8°C
[form ]

Liquid
[pka]

4.17±0.25(Predicted)
[color ]

Clear colorless to yellow
[Water Solubility ]

Soluble in water.
[Sensitive ]

Air Sensitive
[Detection Methods]

HPLC
[InChIKey]

UEBFLTZXUXZPJO-UHFFFAOYSA-N
[CAS DataBase Reference]

13750-81-7(CAS DataBase Reference)
[NIST Chemistry Reference]

1H-imidazole-2-carboxaldehyde, 1-methyl-(13750-81-7)
[Storage Precautions]

Store under nitrogen
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

R36/37/38:Irritating to eyes, respiratory system and skin .
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection .
[WGK Germany ]

3
[HazardClass ]

IRRITANT
[HS Code ]

29339900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Tetrahydrofuran-->n-Butyllithium-->Hexane-->Ethyl formate-->1-Methylimidazole-->Iodomethane-->Imidazole-2-carboxaldehyde
[Preparation Products]

1H-Imidazole-2-carboxylicacid,1-methyl-,methylester(9CI)-->1-Methyl-1H-imidazole-2-carboxylic acid
Hazard InformationBack Directory
[Chemical Properties]

White to yellow crystalline mass,
[Uses]

1-Methyl-2-imidazolecarboxaldehyde may be used in the synthesis of:
  • Schiff bases
  • ligand N,N-dimethyl-N′-(1-methylimidazole-2-ylmethyl)-ethylenediamine
  • [(bis(1-methylimidazol-2-yl)methyl)(2-(pyridyl-2-yl)ethyl)amine]
[Uses]

It is an important raw material and intermediate used in organic synthesis, Pharmaceuticals, agrochemicals and dyestuffs.
[Synthesis Reference(s)]

Journal of Medicinal Chemistry, 26, p. 121, 1983 DOI: 10.1021/jm00356a001
[General Description]

1-Methyl-2-imidazolecarboxaldehyde is a heterocyclic building block. It affords tripodal ligands on condensation reaction with tris-(2-aminoethyl)amine (tren). These tripodal ligands react with iron(III) salts in the presence of air to afford iron(II) complexes. Its vibrational spectral studies have been reported.
Spectrum DetailBack Directory
[Spectrum Detail]

1-Methyl-2-imidazolecarboxaldehyde(13750-81-7)IR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Methyl-2-imidazolecarboxaldehyde, 98%(13750-81-7)
[Sigma Aldrich]

13750-81-7(sigmaaldrich)
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