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39021-62-0

39021-62-0 Structure

39021-62-0 Structure
IdentificationMore
[Name]

1-METHYL-1H-IMIDAZOLE-5-CARBOXALDEHYDE
[CAS]

39021-62-0
[Synonyms]

1-METHYL-1H-IMIDAZOLE-5-CARBALDEHYDE
1-METHYL-1H-IMIDAZOLE-5-CARBOXALDEHYDE
1-METHYL-5-IMIDAZOLECARBOXALDEHYDE
1-METHYLIMIDAZOLE-5-CARBOXALDEHYDE
1-METHYLIMIDAZOLE-5-CARBOXALDEYDE
3-METHYL-3H-IMIDAZOLE-4-CARBALDEHYDE
TIMTEC-BB SBB010122
1-Methyl-1h-imidazole-5-carbaldehyde, 90+%
[Molecular Formula]

C5H6N2O
[MDL Number]

MFCD00030439
[Molecular Weight]

110.11
[MOL File]

39021-62-0.mol
Questions And AnswerBack Directory
[Synthesis]

Starting with 5-aldehyde imidazolium and methyl trifluoromethanesulfonate, this study aimed to develop a promising industrial process for producing 1-METHYL-1H-IMIDAZOLE-5-CARBOXALDEHYDE. Various catalysts were screened, and the effects of reaction time, temperature, feed ratio, and pressure on imidazolium conversion and 2-chloro-1-methyl-1H-imidazolium yield were investigated. The reaction conditions were optimized, and the optimal process conditions were determined. The synthetic reaction formula is shown in the figure below:

Synthesis of 39021-62-0

Chemical PropertiesBack Directory
[Melting point ]

52-57 °C
[Boiling point ]

120-130°C 2mm
[density ]

1.14±0.1 g/cm3(Predicted)
[Fp ]

>230 °F
[storage temp. ]

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

solid
[pka]

3.87±0.10(Predicted)
[color ]

Light yellow
[Sensitive ]

Air Sensitive
[Detection Methods]

HPLC
[InChI]

InChI=1S/C5H6N2O/c1-7-4-6-2-5(7)3-8/h2-4H,1H3
[InChIKey]

BNYKZFOZWZMEJD-UHFFFAOYSA-N
[SMILES]

C1N(C)C(C=O)=CN=1
[CAS DataBase Reference]

39021-62-0(CAS DataBase Reference)
[Storage Precautions]

Store under nitrogen;Air sensitive
Safety DataBack Directory
[Hazard Codes ]

Xn,Xi
[Risk Statements ]

R22:Harmful if swallowed.
R36/37/38:Irritating to eyes, respiratory system and skin .
R43:May cause sensitization by skin contact.
[Safety Statements ]

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

3
[Hazard Note ]

Irritant
[HazardClass ]

IRRITANT
[HS Code ]

29332900
Raw materials And Preparation ProductsBack Directory
[Raw materials]

Acetic acid-->Nitric acid-->Chloroform-->Sodium nitrite-->Potassium permanganate-->Isopropyl alcohol-->1-Butanol-->Potassium thiocyanate-->Manganese sulfate monohydrate-->Methylamine hydrochloride-->2,5-Dihydroxy-1,4-dioxane-2,5-dimethanol
[Preparation Products]

(1-Methyl-1H-imidazol-5-yl)methanol-->4-(1-methyl-1H-imidazol-5-yl)pyrrolidin-2-one-->2-Propenoic acid, 3-(1-methyl-1H-imidazol-5-yl)-, ethyl ester
Hazard InformationBack Directory
[Uses]

1-Methyl-1H-imidazole-5-carbaldehyde used as a photoresponsive polymer and metal-organic backbone material for the preparation of hybrid matrix membranes.
Spectrum DetailBack Directory
[Spectrum Detail]

1-METHYL-1H-IMIDAZOLE-5-CARBOXALDEHYDE(39021-62-0)1HNMR
Well-known Reagent Company Product InformationBack Directory
[Acros Organics]

1-Methyl-1H-imidazole-5-carbaldehyde, 97%(39021-62-0)
[Alfa Aesar]

1-Methylimidazole-5-carboxaldehyde, 97%(39021-62-0)
[Sigma Aldrich]

39021-62-0(sigmaaldrich)
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