N-[N-(Chloroacetyl)Glycyl]-DL-Valine
[CAS# 94088-95-6]

Identification

• Name: N-[N-(Chloroacetyl)Glycyl]-DL-Valine
• Synonyms: 2-[[2-[(2-Chloroacetyl)Amino]Acetyl]Amino]-3-Methyl-Butanoic Acid; 2-[[2-[(2-Chloro-1-Oxoethyl)Amino]-1-Oxoethyl]Amino]-3-Methylbutanoic Acid; 2-[[2-[(2-Chloroacetyl)Amino]Acetyl]Amino]-3-Methyl-Butyric Acid
• Molecular Formula: C₉H₁₅ClN₂O₄
• Molecular Weight: 250.68
• CAS Registry Number: 94088-95-6
• EINECS: 302-097-8
• SMILES: C(C(NC(C(C)C)C(O)=O)=O)NC(CCl)=O
• InChI: 1S/C9H15ClN2O4/c1-5(2)8(9(15)16)12-7(14)4-11-6(13)3-10/h5,8H,3-4H2,1-2H3,(H,11,13)(H,12,14)(H,15,16)
• InChIKey: BKNMSZCXSKJYBI-UHFFFAOYSA-N

Properties

• Density: 1.281g/cm³ (Cal.)
• Boiling point: 564.057°C at 760 mmHg (Cal.)
• Flash point: 294.931°C (Cal.)