ChemicalBook--->CAS DataBase List--->78449-67-9

78449-67-9

78449-67-9 Structure

78449-67-9 Structure
IdentificationBack Directory
[Name]

3,5-DIMETHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID
[CAS]

78449-67-9
[Synonyms]

1,4-Dimethylimidazole-5-carboxylic acid
3,5-DIMETHYL-3H-IMIDAZOLE-4-CARBOXYLIC ACID
1,4-Dimethyl-1H-imidazole-5-carboxylic acid
1H-Imidazole-5-carboxylic acid, 1,4-dimethyl-
3,5-Dimethyl-3H-imidazole-4-carboxylic acid ,98%
1,4-Dimethyl-1H-imidazole-5-carboxylic acid 95% (elemental analysis)
[Molecular Formula]

C6H8N2O2
[MDL Number]

MFCD08063163
[MOL File]

78449-67-9.mol
[Molecular Weight]

140.14
Chemical PropertiesBack Directory
[Melting point ]

210-215°C
[Boiling point ]

386.0±22.0 °C(Predicted)
[density ]

1.28±0.1 g/cm3(Predicted)
[storage temp. ]

2-8°C
[form ]

solid
[pka]

1.59±0.32(Predicted)
[InChI]

1S/C6H8N2O2/c1-4-5(6(9)10)8(2)3-7-4/h3H,1-2H3,(H,9,10)
[InChIKey]

OPSKQGQJCODPET-UHFFFAOYSA-N
[SMILES]

CN1C(C(O)=O)=C(C)N=C1
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26
[WGK Germany ]

3
[HS Code ]

2933299090
[Storage Class]

11 - Combustible Solids
[Hazard Classifications]

Eye Irrit. 2
Skin Irrit. 2
STOT SE 3
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