3-[(Benzylamino)Methyl]-6,7-Dihydroxy-3H-2-Benzofuran-1-One Hydrobromide
[CAS# 78219-09-7]

Identification

• Name: 3-[(Benzylamino)Methyl]-6,7-Dihydroxy-3H-2-Benzofuran-1-One Hydrobromide
• Synonyms: 3-[(Benzylamino)Methyl]-6,7-Dihydroxy-3H-Isobenzofuran-1-One Hydrobromide; 6,7-Dihydroxy-3-[(Phenylmethylamino)Methyl]-3H-2-Benzofuran-1-One Hydrobromide; 3-Benzylaminomethyl-6,7-Dihydroxyphthalide Hydrobromide
• Molecular Formula: C₁₆H₁₆BrNO₄
• Molecular Weight: 366.21
• CAS Registry Number: 78219-09-7
• SMILES: [H+].C1=CC(=C(O)C2=C1C(OC2=O)CNCC3=CC=CC=C3)O.[Br-]
• InChI: 1S/C16H15NO4.BrH/c18-12-7-6-11-13(21-16(20)14(11)15(12)19)9-17-8-10-4-2-1-3-5-10;/h1-7,13,17-19H,8-9H2;1H
• InChIKey: SLTCOUTZZCCLEX-UHFFFAOYSA-N

Properties

• Boiling point: 530.4°C at 760 mmHg (Cal.)
• Flash point: 274.6°C (Cal.)