N-(3-Chloro-1,4-dihydro-1,4-dioxo-2-naphthalenyl)-L-valine compd. with morpholine (1:1)
[CAS# 180179-66-2]

Identification

• Name: N-(3-Chloro-1,4-dihydro-1,4-dioxo-2-naphthalenyl)-L-valine compd. with morpholine (1:1)
• Synonyms: (2S)-2-[(3-Chloro-1,4-Dioxo-2-Naphthyl)Amino]-3-Methyl-Butanoic Acid; Morpholine; (2S)-2-[(3-Chloro-1,4-Dioxo-2-Naphthyl)Amino]-3-Methylbutanoic Acid; Morpholine; (2S)-2-[(3-Chloro-1,4-Diketo-2-Naphthyl)Amino]-3-Methyl-Butyric Acid; Morpholine
• Molecular Formula: C₁₉H₂₃ClN₂O₅
• Molecular Weight: 394.85
• CAS Registry Number: 180179-66-2
• SMILES: [C@@H](NC1=C(Cl)C(=O)C2=C(C1=O)C=CC=C2)(C(=O)O)C(C)C.C3OCCNC3
• InChI: 1S/C15H14ClNO4.C4H9NO/c1-7(2)11(15(20)21)17-12-10(16)13(18)8-5-3-4-6-9(8)14(12)19;1-3-6-4-2-5-1/h3-7,11,17H,1-2H3,(H,20,21);5H,1-4H2/t11-;/m0./s1
• InChIKey: GUMZDOISFUFSNI-MERQFXBCSA-N

Properties

• Boiling point: 461.5°C at 760 mmHg (Cal.)
• Flash point: 232.9°C (Cal.)