7-[2-(Benzylamino)Ethyl]-3,7-Dihydro-1,3-Dimethyl-1H-Purine-2,6-Dione Monohydrochloride
[CAS# 1236-36-8]

Identification

• Name: 7-[2-(Benzylamino)Ethyl]-3,7-Dihydro-1,3-Dimethyl-1H-Purine-2,6-Dione Monohydrochloride
• Synonyms: 7-[2-(Benzylamino)Ethyl]-1,3-Dimethyl-Purine-2,6-Dione Hydrochloride; 7-[2-(Benzylamino)Ethyl]-1,3-Dimethyl-Xanthine Hydrochloride; 1,3-Dimethyl-7-[2-(Phenylmethylamino)Ethyl]Purine-2,6-Dione Hydrochloride
• Molecular Formula: C₁₆H₂₀ClN₅O₂
• Molecular Weight: 349.82
• CAS Registry Number: 1236-36-8
• EINECS: 214-977-8
• SMILES: [H+].C1=NC3=C([N]1CCNCC2=CC=CC=C2)C(=O)N(C(=O)N3C)C.[Cl-]
• InChI: 1S/C16H19N5O2.ClH/c1-19-14-13(15(22)20(2)16(19)23)21(11-18-14)9-8-17-10-12-6-4-3-5-7-12;/h3-7,11,17H,8-10H2,1-2H3;1H
• InChIKey: ZDYNLEXCQDOPCC-UHFFFAOYSA-N

Properties

• Boiling point: 546.5°C at 760 mmHg (Cal.)
• Flash point: 284.3°C (Cal.)