Hexyl 4-amino-4-phenylbutanoate hydrochloride (1:1)
[CAS# 87253-02-9]

Identification

• Name: Hexyl 4-amino-4-phenylbutanoate hydrochloride (1:1)
• Synonyms: Benzenebutanoic acid, γ-amino-, hexyl ester, hydrochloride, (±)-; Butyric acid, 4-amino-4-phenyl-, hexyl ester, hydrochloride, DL-
• Molecular Formula: C₁₆H₂₆ClNO₂
• Molecular Weight: 299.84
• CAS Registry Number: 87253-02-9
• SMILES: Cl.O=C(OCCCCCC)CCC(N)c1ccccc1
• InChI: 1S/C16H25NO2.ClH/c1-2-3-4-8-13-19-16(18)12-11-15(17)14-9-6-5-7-10-14;/h5-7,9-10,15H,2-4,8,11-13,17H2,1H3;1H
• InChIKey: KOLMGFYKKQZWFX-UHFFFAOYSA-N

Properties

• Boiling point: 375.3°C at 760 mmHg (Cal.)
• Flash point: 214.7°C (Cal.)