6-Hydroxy-3,4-dihydro-2H-isoquinolin-1-one

• CAS: 22245-98-3
• Catalog Number: ACM22245983
• Category: Other Products
• Molecular Weight: 163.1756
• Molecular Formula: C9H9NO2
• Synonyms: 6-Hydroxy-3,4-dihydro-2H-isoquinolin-1-one;6-Hydroxy-3,4-dihydroisoquinolin-1(2H)-one
• IUPAC Name: 6-hydroxy-3,4-dihydro-2H-isoquinolin-1-one
• Canonical SMILES: C1CNC(=O)C2=C1C=C(C=C2)O
• InChI Key: TYNQFYSVGOMKOS-UHFFFAOYSA-N
• Boiling Point: 503.151ºC at 760 mmHg
• Flash Point: 258.097ºC
• Density: 1.283g/cm³
• Exact Mass: 163.06300
• H-Bond Acceptor: 2
• H-Bond Donor: 2
• MDL Number: MFCD08059297
• Size: 100mg,250mg,500mg,1g,5g,25g

Synthetic Use

Upstream Synthesis Route 1

• 22246-12-4

• 22245-98-3

Reference: [1] Bioorganic and Medicinal Chemistry Letters, 2012, vol. 22, # 2, p. 814 - 819

Upstream Synthesis Route 2

• 3470-49-3

• 22245-98-3

Reference: [1] Patent: US2005/222203, 2005, A1, . Location in patent: Page/Page column 19-20

Upstream Synthesis Route 3

• 3470-49-3
• 76-03-9

• 22245-98-3

Reference: [1] Molecular Pharmaceutics, 2018, vol. 15, # 2, p. 458 - 471

Downstream Synthesis Route 1

• 22245-98-3
• 100-39-0

• 164147-66-4

Reference: [1]Journal of Medicinal Chemistry,1997,vol. 40,p. 2085 - 2101

Downstream Synthesis Route 2

• 22245-98-3

• 164147-68-6

Reference: [1]Journal of Medicinal Chemistry,1997,vol. 40,p. 2085 - 2101

* For details of the synthesis route, please refer to the original source to ensure accuracy.