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Home >> Chemical Listing >> Page 499 >> 4-Cyano-1-Methyl-1H-Imidazole-5-Carboxylic Acid

4-Cyano-1-Methyl-1H-Imidazole-5-Carboxylic Acid
[CAS# 146091-76-1]

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Identification
Name 4-Cyano-1-Methyl-1H-Imidazole-5-Carboxylic Acid
Synonyms 4-cyano-1-methyl-1H-imidazole-5-carboxylic acid
Molecular Structure CAS#: 146091-76-1, 4-Cyano-1-Methyl-1H-Imidazole-5-Carboxylic Acid
Molecular Formula C6H5N3O2
Molecular Weight 151.12
CAS Registry Number 146091-76-1
SMILES Cn1cnc(c1C(=O)O)C#N
InChI 1S/C6H5N3O2/c1-9-3-8-4(2-7)5(9)6(10)11/h3H,1H3,(H,10,11)
InChIKey ZKRPZVXOCOLIFW-UHFFFAOYSA-N
Properties
Density 1.419g/cm3 (Cal.)
Boiling point 493.875°C at 760 mmHg (Cal.)
Flash point 252.487°C (Cal.)
Refractive index 1.634 (Cal.)
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