ChemicalBook--->CAS DataBase List--->91874-85-0

91874-85-0

91874-85-0 Structure

91874-85-0 Structure
IdentificationBack Directory
[Name]

(1H-imidazol-4-yl)methanone
[CAS]

91874-85-0
[Synonyms]

Medetomidine RC8
Dexmedetomidine-023
Dexmedetomidine Impurity Vl
(1H-imidazol-4-yl)methanone
Medetomidine Ketone Impurity
4-(2',3'-DiMethylbenzoyl)iMidazole
Dexmedetomidine Hydrochloride Impurity D
(2,3-Dimethylphenyl)(4-imidazolyl)methanone
(2,3-diMethylphenyl)(1H-iMidazol-4-yl)Methanone
Methanone, (2,3-dimethylphenyl)-1H-imidazol-4-yl-
Methanone, (2,3-dimethylphenyl)-1H-imidazol-5-yl-
Methanone, (2,3-dimethylphenyl)-1H-imidazol-4-yl- chemistry
[Molecular Formula]

C12H12N2O
[MDL Number]

MFCD21332884
[MOL File]

91874-85-0.mol
[Molecular Weight]

200.24
Chemical PropertiesBack Directory
[Boiling point ]

412.7±33.0 °C(Predicted)
[density ]

1.166±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

Chloroform (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

10.30±0.10(Predicted)
[color ]

White to Pale Brown
[Major Application]

pharmaceutical
[InChI]

InChI=1S/C12H12N2O/c1-8-4-3-5-10(9(8)2)12(15)11-6-13-7-14-11/h3-7H,1-2H3,(H,13,14)
[InChIKey]

RXMJMOMMINVJMY-UHFFFAOYSA-N
[SMILES]

C(C1=CC=CC(C)=C1C)(C1NC=NC=1)=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Acute Tox. 4 Oral
Aquatic Chronic 2
Hazard InformationBack Directory
[Uses]

(2,3-Dimethylphenyl)-1H-imidazol-5-ylmethanone was used for tandem addition reduction to synthesize 4(5)?-?[1-?(2,?3-?dimethylphenyl)?-?1H-?imidazole, the α2-?adrenergic agonist medetomidine.
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