Thieno[2,3-c]pyridine,4,5,6,7-tetrahydro-, hydrochloride (1:1)

The Thieno[2,3-c]pyridine,4,5,6,7-tetrahydro-, hydrochloride (1:1), with the CAS registry number 28783-38-2, is also known as 4,5,6,7-Tetrahydrothieno[2,3-c]pyridinhydrochlorid. It belongs to the product categories of API intermediates; Chiral chemicals; Building Blocks; Thieno[x,x-y]pyridine. This chemical's molecular formula is C₇H₉NS·ClH and formula weight is 175.68. What's more, its systematic name is 4,5,6,7-tetrahydrothieno[2,3-c]pyridin-6-ium chloride.

Physical properties of Thieno[2,3-c]pyridine,4,5,6,7-tetrahydro-, hydrochloride (1:1) are: (1)ACD/LogP: 1.08; (2)# of Rule of 5 Violations: 0; (3)ACD/BCF (pH 5.5): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1.94; (6)#H bond acceptors: 1; (7)#H bond donors: 1; (8)#Freely Rotating Bonds: 0; (9)Polar Surface Area: 44.85 Å²; (10)Flash Point: 122.1 °C; (11)Enthalpy of Vaporization: 52.73 kJ/mol; (12)Boiling Point: 278.3 °C at 760 mmHg; (13)Vapour Pressure: 0.00331 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].C1C[NH2+]Cc2sccc12
(2)InChI: InChI=1S/C7H9NS.ClH/c1-3-8-5-7-6(1)2-4-9-7;/h2,4,8H,1,3,5H2;1H
(3)InChIKey: VQEOIFRMJGFLQH-UHFFFAOYSA-N