N-(3,4-Dihydro-3,3-dimethyl-1-isoquinolinyl)-L-Methionine
[CAS 187884-93-1]

Identification

• Name: N-(3,4-Dihydro-3,3-dimethyl-1-isoquinolinyl)-L-Methionine
• Synonyms: (2S)-2-[(3,3-Dimethyl-2,4-Dihydroisoquinolin-1-Ylidene)Azaniumyl]-4-Methylsulfanyl-Butanoate; (2S)-2-[(3,3-Dimethyl-2,4-Dihydroisoquinolin-1-Ylidene)Azaniumyl]-4-(Methylthio)Butanoate; (2S)-2-[(3,3-Dimethyl-2,4-Dihydroisoquinolin-1-Ylidene)Azaniumyl]-4-(Methylthio)Butyrate
• Molecular Formula: C₁₆H₂₂N₂O₂S
• Molecular Weight: 306.42
• CAS Registry Number: 187884-93-1
• SMILES: [C@@H]([NH+]=C1NC(CC2=C1C=CC=C2)(C)C)(C([O-])=O)CCSC
• InChI: 1S/C16H22N2O2S/c1-16(2)10-11-6-4-5-7-12(11)14(18-16)17-13(15(19)20)8-9-21-3/h4-7,13H,8-10H2,1-3H3,(H,17,18)(H,19,20)/t13-/m0/s1
• InChIKey: ZMGKDFXVKGOIRI-ZDUSSCGKSA-N

Properties

• Density: 1.204g/cm³ (Cal.)
• Boiling point: 528.48°C at 760 mmHg (Cal.)
• Flash point: 273.415°C (Cal.)