Isoindoline hydrochloride

Base Information

• Chemical Name: Isoindoline hydrochloride
• CAS No.: 32372-82-0
• Molecular Formula: C8H10ClN
• Molecular Weight: 155.627
• Hs Code.: 2933990090
• European Community (EC) Number: 675-776-2
• DSSTox Substance ID: DTXSID50487241
• Mol file: 32372-82-0.mol

Synonyms:isoindoline hydrochloride;32372-82-0;2,3-Dihydroisoindole hydrochloride;2,3-dihydro-1H-isoindole hydrochloride;ISOINDOLINE HCL;Isoindoline, HCl;2,3-dihydro-1H-isoindole;hydrochloride;MFCD03502377;2,3-Dihydro-1H-isoindol hydrochloride;Isoindoline HCl salt;2,3-Dihydro-1H-isoindole HCl;1H-Isoindole, 2,3-dihydro-, hydrochloride;SCHEMBL4702076;DTXSID50487241;NOVIRODZMIZUPA-UHFFFAOYSA-N;BCP15681;CS-D1516;SC3601;2,3-Dihydro-1H-isoindolehydrochloride;AKOS015844749;GS-3911;SB66088;SY006502;A5807;AM20120611;FT-0602204;I0958;EN300-70584;J-506987;J-650388;F1993-0036;Z1263820391

Chemical Property of Isoindoline hydrochloride

Chemical Property:

• Vapor Pressure: 0.0317mmHg at 25°C
• Melting Point: 255-256℃
• Boiling Point: 239.8 °C at 760 mmHg
• Flash Point: 98.8 °C
• PSA: 12.36000
• LogP: 1.85670
• Storage Temp.: Inert atmosphere,Store in freezer, under -20°C
• Sensitive.: Hygroscopic
• Water Solubility.: Soluble in water.
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 155.0501770
• Heavy Atom Count: 10
• Complexity: 88.7

Purity/Quality:

99%, ^*data from raw suppliers

Isoindoline hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=CC=CC=C2CN1.Cl
• Uses: Isoindoline hydrochloride is used as pharmaceutical intermediate.

Technology Process of Isoindoline hydrochloride

There total 9 articles about Isoindoline hydrochloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 82.0%

→ dihydroisoindole hydrochloride (32372-82-0)

Guidance literature:

Reference yield: 79.0%

phthalimide (136918-14-4,85-41-6) → dihydroisoindole hydrochloride (32372-82-0)

Guidance literature:

phthalimide; With bis(cyclopentadienyl)dihydrozirconium; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; at 20 ℃; for 12h; under 760.051 Torr; Inert atmosphere;

With hydrogenchloride; In diethyl ether; Inert atmosphere;

Reference yield: 69.0%

C22H21NSe*ClH → dihydroisoindole hydrochloride (32372-82-0)

Guidance literature:

With dihydrogen peroxide; In methanol; water;

DOI:10.3390/molecules26092770

upstream raw materials:

o-chloromethylbenzylamine

dipropargylamine

acetylene

phthalonitrile

Downstream raw materials:

isoindoline-2-carbothioamide

cis-hexahydroisoindoline

Refernces

• 1、 Young, Douglas D.,Senaiar, Ramesh S.,Deiters, Alexander. "Solid-supported [2+2+2] cyclotrimerizations". . p. 5563 - 5568. Retrieved 2006.
• 2、 Bortoli, Marco,Gianoncelli, Alessandra,Ongaro, Alberto,Orian, Laura,Oselladore, Erika,Ribaudo, Giovanni,Zagotto, Giuseppe. "Selenoxide elimination triggers enamine hydrolysis to primary and secondary amines: A combined experimental and theoretical investigation". . . Retrieved 2021/05/26.
• 3、 Xu, Feng,Simmons, Bryon. "One-pot preparation of cyclic amines from amino alcohols". . p. 251 - 260. Retrieved 2014/04/03.