9-(Pyrrolidin-1-Ylmethyl)-8-Thiabicyclo[4.3.0]Nona-1,3,5-Trien-7-One Hydrochloride
[CAS# 97873-31-9]

Identification

• Name: 9-(Pyrrolidin-1-Ylmethyl)-8-Thiabicyclo[4.3.0]Nona-1,3,5-Trien-7-One Hydrochloride
• Synonyms: 3-(1-Pyrrolidinylmethyl)-3H-2-Benzothiophen-1-One Hydrochloride; 3-(Pyrrolidin-1-Ylmethyl)-3H-Isobenzothiophen-1-One Hydrochloride; 3-(1-Pyrrolidinylmethyl)Benzo(C)Thiophen-1(3H)-One Hydrochloride
• Molecular Formula: C₁₃H₁₆ClNOS
• Molecular Weight: 269.79
• CAS Registry Number: 97873-31-9
• SMILES: [H+].C1=C2C(=CC=C1)C(SC2CN3CCCC3)=O.[Cl-]
• InChI: 1S/C13H15NOS.ClH/c15-13-11-6-2-1-5-10(11)12(16-13)9-14-7-3-4-8-14;/h1-2,5-6,12H,3-4,7-9H2;1H
• InChIKey: DSJABSPWDPDHBG-UHFFFAOYSA-N

Properties

• Boiling point: 335.2°C at 760 mmHg (Cal.)
• Flash point: 156.5°C (Cal.)