Nafagrel hydrochloride
[CAS# 97901-21-8]

Identification

• Name: Nafagrel hydrochloride
• Synonyms: 2-(Imidazol-1-Ylmethyl)Tetralin-6-Carboxylic Acid Hydrochloride; 2-(1-Imidazolylmethyl)-6-Tetralincarboxylic Acid Hydrochloride; 2-Naphthalenecarboxylic Acid, 5,6,7,8-Tetrahydro-6-(1H-Imidazol-1-Ylmethyl)-, Monohydrochloride, Hemihydrate
• Molecular Formula: C₁₅H₁₇ClN₂O₂
• Molecular Weight: 292.76
• CAS Registry Number: 97901-21-8 (97901-22-9)
• SMILES: [H+].C1=CC(=CC2=C1CC(CC2)C[N]3C=CN=C3)C(O)=O.[Cl-]
• InChI: 1S/C15H16N2O2.ClH/c18-15(19)14-4-3-12-7-11(1-2-13(12)8-14)9-17-6-5-16-10-17;/h3-6,8,10-11H,1-2,7,9H2,(H,18,19);1H
• InChIKey: DRWRJLPMUWWEHY-UHFFFAOYSA-N

Properties

• Boiling point: 507.6°C at 760 mmHg (Cal.)
• Flash point: 260.8°C (Cal.)