1H-Isoindol-1-one, 2-amino-2,3-dihydro-

Base Information

• Chemical Name: 1H-Isoindol-1-one, 2-amino-2,3-dihydro-
• CAS No.: 23990-34-3
• Molecular Formula: C₈H₈N₂O
• Molecular Weight: 148.164
• DSSTox Substance ID: DTXSID30351855
• Nikkaji Number: J743.369G
• Wikidata: Q82128638
• Mol file: 23990-34-3.mol

Synonyms:1H-Isoindol-1-one, 2-amino-2,3-dihydro-;23990-34-3;2-amino-3H-isoindol-1-one;N-aminophthalimidine;SCHEMBL2461097;DTXSID30351855;STL490754;AKOS002664596;2-amino-2,3-dihydro-1H-isoindol-1-one

Chemical Property of 1H-Isoindol-1-one, 2-amino-2,3-dihydro-

Chemical Property:

• PSA: 46.33000
• LogP: 1.15430
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 148.063662883
• Heavy Atom Count: 11
• Complexity: 181

Purity/Quality:

2-amino-2,3-dihydro-1H-Isoindol-1-one 97.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C2=CC=CC=C2C(=O)N1N

Technology Process of 1H-Isoindol-1-one, 2-amino-2,3-dihydro-

There total 3 articles about 1H-Isoindol-1-one, 2-amino-2,3-dihydro- 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: 94.0%

2-(tert-butyloxycarbonylamino)isoindolin-1-one (1096160-26-7) → 2-aminoisoindolin-1-one (23990-34-3)

Guidance literature:

With hydrogenchloride; In ethyl acetate; at 0 - 20 ℃; Inert atmosphere;

DOI:10.1002/jhet.2197

Reference yield:

carbazic acid (471-31-8) + o-carboxybenzaldehyde (119-67-5) → 2-aminoisoindolin-1-one (23990-34-3)

Guidance literature:

palladium-carbon; In methanol; water; ethyl acetate;

Reference yield:

→ 2-aminoisoindolin-1-one (23990-34-3)

Guidance literature:

1,2,3,4-Tetrahydro-phthalazin-1-on, Hydrazin;

upstream raw materials:

carbazic acid

o-carboxybenzaldehyde

2-(tert-butyloxycarbonylamino)isoindolin-1-one

Downstream raw materials:

3-[(1-oxo-1,3-dihydro-isoindol-2-ylimino)-methyl]-rifamycin