4'-Aminomethyltrioxsalen Hydrochloride
[CAS# 62442-61-9]

Identification

• Name: 4'-Aminomethyltrioxsalen Hydrochloride
• Synonyms: 3-(Aminomethyl)-2,5,9-Trimethyl-Furo[3,2-G]Chromen-7-One Hydrochloride; 3-(Aminomethyl)-2,5,9-Trimethyl-7-Furo[3,2-G]Chromenone Hydrochloride; Trioxsalen, 4″ -Aminomethyl-, Hydrochloride
• Molecular Formula: C₁₅H₁₆ClNO₃
• Molecular Weight: 293.75
• CAS Registry Number: 62442-61-9 (64358-50-5)
• SMILES: [H+].C1=C3C(=C(C2=C1C(=C(O2)C)CN)C)OC(=O)C=C3C.[Cl-]
• InChI: 1S/C15H15NO3.ClH/c1-7-4-13(17)19-14-8(2)15-11(5-10(7)14)12(6-16)9(3)18-15;/h4-5H,6,16H2,1-3H3;1H
• InChIKey: HAWQZPVGCLHOBD-UHFFFAOYSA-N

Properties

• Boiling point: 453.4°C at 760 mmHg (Cal.)
• Flash point: 228°C (Cal.)