Heptyl L-phenylalaninate hydrochloride (1:1)
[CAS# 87253-04-1]

Identification

• Name: Heptyl L-phenylalaninate hydrochloride (1:1)
• Synonyms: Alanine, 3-phenyl-, heptyl ester, hydrochloride, DL-; DL-3-Phenylalanine heptyl ester hydrochloride
• Molecular Formula: C₁₆H₂₆ClNO₂
• Molecular Weight: 299.84
• CAS Registry Number: 87253-04-1
• SMILES: Cl.O=C(OCCCCCCC)[C@@H](N)Cc1ccccc1
• InChI: 1S/C16H25NO2.ClH/c1-2-3-4-5-9-12-19-16(18)15(17)13-14-10-7-6-8-11-14;/h6-8,10-11,15H,2-5,9,12-13,17H2,1H3;1H/t15-;/m0./s1
• InChIKey: DWBUUNGHEPWMLR-RSAXXLAASA-N

Properties

• Boiling point: 361.5°C at 760 mmHg (Cal.)
• Flash point: 204.1°C (Cal.)