Sodium (R)-[(3-Methoxy-1-Methyl-3-Oxoprop-1-Enyl)Amino]Phenylacetate
[CAS# 13291-96-8]

Identification

• Name: Sodium (R)-[(3-Methoxy-1-Methyl-3-Oxoprop-1-Enyl)Amino]Phenylacetate
• Synonyms: Sodium (2R)-2-[[(E)-3-Methoxy-1-Methyl-3-Oxo-Prop-1-Enyl]Amino]-2-Phenyl-Acetate; Sodium (2R)-2-[[(E)-3-Methoxy-1-Methyl-3-Oxoprop-1-Enyl]Amino]-2-Phenylacetate; Sodium (2R)-2-[[(E)-3-Keto-3-Methoxy-1-Methyl-Prop-1-Enyl]Amino]-2-Phenyl-Acetate
• Molecular Formula: C₁₃H₁₄NNaO₄
• Molecular Weight: 271.25
• CAS Registry Number: 13291-96-8
• EINECS: 236-309-4
• SMILES: [C@@H](NC(=C/C(OC)=O)/C)(C1=CC=CC=C1)C([O-])=O.[Na+]
• InChI: 1S/C13H15NO4.Na/c1-9(8-11(15)18-2)14-12(13(16)17)10-6-4-3-5-7-10;/h3-8,12,14H,1-2H3,(H,16,17);/q;+1/p-1/b9-8+;/t12-;/m1./s1
• InChIKey: VWAWMPXOFHGGMY-UYZIEVLVSA-M

Properties

• Boiling point: 418.7°C at 760 mmHg (Cal.)
• Flash point: 207°C (Cal.)