N-(3-Chloro-1,4-dihydro-1,4-dioxo-2-naphthalenyl)-L-leucine compd. with morpholine (1:1)
[CAS# 180179-68-4]

Identification

• Name: N-(3-Chloro-1,4-dihydro-1,4-dioxo-2-naphthalenyl)-L-leucine compd. with morpholine (1:1)
• Synonyms: (2S)-2-[(3-Chloro-1,4-Dioxo-2-Naphthyl)Amino]-4-Methyl-Pentanoic Acid; Morpholine; (2S)-2-[(3-Chloro-1,4-Dioxo-2-Naphthyl)Amino]-4-Methylpentanoic Acid; Morpholine; (2S)-2-[(3-Chloro-1,4-Diketo-2-Naphthyl)Amino]-4-Methyl-Valeric Acid; Morpholine
• Molecular Formula: C₂₀H₂₅ClN₂O₅
• Molecular Weight: 408.88
• CAS Registry Number: 180179-68-4
• SMILES: [C@@H](NC1=C(Cl)C(=O)C2=C(C1=O)C=CC=C2)(C(=O)O)CC(C)C.C3OCCNC3
• InChI: 1S/C16H16ClNO4.C4H9NO/c1-8(2)7-11(16(21)22)18-13-12(17)14(19)9-5-3-4-6-10(9)15(13)20;1-3-6-4-2-5-1/h3-6,8,11,18H,7H2,1-2H3,(H,21,22);5H,1-4H2/t11-;/m0./s1
• InChIKey: VDQNPWJSIMJKCE-MERQFXBCSA-N

Properties

• Boiling point: 471.4°C at 760 mmHg (Cal.)
• Flash point: 238.9°C (Cal.)