tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

Modify Date: 2024-01-09 21:25:41

tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Structure
tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate structure
Common Name tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate
CAS Number 1165923-92-1 Molecular Weight 272.34200
Density N/A Boiling Point N/A
Molecular Formula C16H20N2O2 Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate

 Chemical & Physical Properties

Molecular Formula C16H20N2O2
Molecular Weight 272.34200
Exact Mass 272.15200
PSA 53.33000
LogP 3.09778

 Safety Information

HS Code 2933499090

 Synthetic Route

~89%

tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Structure

tert-butyl 6-cy...

CAS#:1165923-92-1

Literature: Demont, Emmanuel H.; Arpino, Sandra; Bit, Rino A.; Campbell, Colin A.; Deeks, Nigel; Desai, Sapna; Dowell, Simon J.; Gaskin, Pam; Gray, James R. J.; Harrison, Lee A.; Haynes, Andrea; Heightman, Tom D.; Holmes, Duncan S.; Humphreys, Philip G.; Kumar, Umesh; Morse, Mary A.; Osborne, Greg J.; Panchal, Terry; Philpott, Karen L.; Taylor, Simon; Watson, Robert; Willis, Robert; Witherington, Jason Journal of Medicinal Chemistry, 2011 , vol. 54, # 19 p. 6724 - 6733

~%

tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Structure

tert-butyl 6-cy...

CAS#:1165923-92-1

Literature: GLAXO GROUP LIMITED Patent: WO2009/80724 A1, 2009 ; Location in patent: Page/Page column 29 ; WO 2009/080724 A1

~%

tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Structure

tert-butyl 6-cy...

CAS#:1165923-92-1

Literature: GLAXO GROUP LIMITED; BAILEY, James, Matthew; BIT, Rino, Antonio; DEMONT, Emmanuel, Hubert; HARRISON, Lee, Andrew; JONES, Katherine, Louise; SMETHURST, Christian, Alan, Paul; WITHERINGTON, Jason Patent: WO2010/146105 A1, 2010 ; WO 2010/146105 A1

~%

tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Structure

tert-butyl 6-cy...

CAS#:1165923-92-1

Literature: GLAXO GROUP LIMITED; BAILEY, James, Matthew; BIT, Rino, Antonio; DEMONT, Emmanuel, Hubert; HARRISON, Lee, Andrew; JONES, Katherine, Louise; SMETHURST, Christian, Alan, Paul; WITHERINGTON, Jason Patent: WO2010/146105 A1, 2010 ; WO 2010/146105 A1

~%

tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Structure

tert-butyl 6-cy...

CAS#:1165923-92-1

Literature: GLAXO GROUP LIMITED; BAILEY, James, Matthew; BIT, Rino, Antonio; DEMONT, Emmanuel, Hubert; HARRISON, Lee, Andrew; JONES, Katherine, Louise; SMETHURST, Christian, Alan, Paul; WITHERINGTON, Jason Patent: WO2010/146105 A1, 2010 ; WO 2010/146105 A1

~%

tert-butyl 6-cyano-5-methyl-3,4-dihydro-1H-isoquinoline-2-carboxylate Structure

tert-butyl 6-cy...

CAS#:1165923-92-1

Literature: GLAXO GROUP LIMITED; BAILEY, James, Matthew; BIT, Rino, Antonio; DEMONT, Emmanuel, Hubert; HARRISON, Lee, Andrew; JONES, Katherine, Louise; SMETHURST, Christian, Alan, Paul; WITHERINGTON, Jason Patent: WO2010/146105 A1, 2010 ; WO 2010/146105 A1

 Customs

HS Code 2933499090
Summary 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%
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