4-{[(2,5-Dimethyl-3-Furoyl)Amino]Methyl}-5-Methyl-2-Furoic Acid
[CAS 430448-79-6]

Identification

• Name: 4-{[(2,5-Dimethyl-3-Furoyl)Amino]Methyl}-5-Methyl-2-Furoic Acid
• Synonyms: 4-((2,5-dimethylfuran-3-carboxamido)methyl)-5-methylfuran-2-carboxylic acid; 4-([(2,5-DIMETHYL-FURAN-3-CARBONYL)-AMINO]-METHYL)-5-METHYL-FURAN-2-CARBOXYLIC ACID; 4-{[(2,5-dimethyl(3-furyl))carbonylamino]methyl}-5-methylfuran-2-carboxylic ac id
• Molecular Formula: C₁₄H₁₅NO₅
• Molecular Weight: 277.27
• CAS Registry Number: 430448-79-6
• SMILES: CC1=CC(=C(O1)C)C(=O)NCC2=C(OC(=C2)C(=O)O)C
• InChI: 1S/C14H15NO5/c1-7-4-11(9(3)19-7)13(16)15-6-10-5-12(14(17)18)20-8(10)2/h4-5H,6H2,1-3H3,(H,15,16)(H,17,18)
• InChIKey: BKWOSDQVFGPKFT-UHFFFAOYSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 456.2±45.0°C at 760 mmHg (Cal.)
• Flash point: 229.7±28.7°C (Cal.)
• Refractive index: 1.561 (Cal.)

Safety Data

• Safety Description: IRRITANT