DL-3-Phenylalanine Octyl Ester Hydrochloride
[CAS# 49554-10-1]

Identification

• Name: DL-3-Phenylalanine Octyl Ester Hydrochloride
• Synonyms: Octyl (2S)-2-Amino-3-Phenyl-Propanoate Hydrochloride; (2S)-2-Amino-3-Phenylpropanoic Acid Octyl Ester Hydrochloride; (2S)-2-Amino-3-Phenyl-Propionic Acid Octyl Ester Hydrochloride
• Molecular Formula: C₁₇H₂₈ClNO₂
• Molecular Weight: 313.87
• CAS Registry Number: 49554-10-1
• SMILES: [C@@H](N)(C(OCCCCCCCC)=O)CC1=CC=CC=C1.[H+].[Cl-]
• InChI: 1S/C17H27NO2.ClH/c1-2-3-4-5-6-10-13-20-17(19)16(18)14-15-11-8-7-9-12-15;/h7-9,11-12,16H,2-6,10,13-14,18H2,1H3;1H/t16-;/m0./s1
• InChIKey: LCMSTKOWXRZFRM-NTISSMGPSA-N

Properties

• Boiling point: 376.4°C at 760 mmHg (Cal.)
• Flash point: 215.5°C (Cal.)