Benzoic Acid 3-Phenylbutan-2-Amine
[CAS# 6306-72-5]

Identification

• Name: Benzoic Acid 3-Phenylbutan-2-Amine
• Synonyms: Benzoic Acid; (1-Methyl-2-Phenyl-Propyl)Amine; Nsc42045
• Molecular Formula: C₁₇H₂₁NO₂
• Molecular Weight: 271.36
• CAS Registry Number: 6306-72-5
• SMILES: C1=C(C=CC=C1)C(O)=O.C2=C(C(C(C)N)C)C=CC=C2
• InChI: 1S/C10H15N.C7H6O2/c1-8(9(2)11)10-6-4-3-5-7-10;8-7(9)6-4-2-1-3-5-6/h3-9H,11H2,1-2H3;1-5H,(H,8,9)
• InChIKey: WGLHGQOWMGPQIX-UHFFFAOYSA-N

Properties

• Boiling point: 216.5°C at 760 mmHg (Cal.)
• Flash point: 90.6°C (Cal.)