2-BROMO-4-(3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL)BENZONITRILE

Modify Date: 2024-02-04 17:21:22

2-BROMO-4-(3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL)BENZONITRILE Structure
2-BROMO-4-(3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL)BENZONITRILE structure
Common Name 2-BROMO-4-(3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL)BENZONITRILE
CAS Number 908111-29-5 Molecular Weight 358.23200
Density N/A Boiling Point N/A
Molecular Formula C17H16BrN3O Melting Point N/A
MSDS N/A Flash Point N/A

 Names

Name 2-bromo-4-(3,6,6-trimethyl-4-oxo-5,7-dihydroindazol-1-yl)benzonitrile

 Chemical & Physical Properties

Molecular Formula C17H16BrN3O
Molecular Weight 358.23200
Exact Mass 357.04800
PSA 58.68000
LogP 3.96998

 Safety Information

HS Code 2933990090

 Synthetic Route

~91%

2-BROMO-4-(3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL)BENZONITRILE Structure

2-BROMO-4-(3,6,...

CAS#:908111-29-5

Literature: Huang, Kenneth H.; Veal, James M.; Fadden, R. Patrick; Rice, John W.; Eaves, Jeron; Strachan, Jon-Paul; Barabasz, Amy F.; Foley, Briana E.; Barta, Thomas E.; Ma, Wei; Silinski, Melanie A.; Hu, Mei; Partridge, Jeffrey M.; Scott, Anisa; DuBois, Laura G.; Freed, Tiffany; Steed, Paul M.; Ommen, Andy J.; Smith, Emilie D.; Hughes, Philip F.; Woodward, Angela R.; Hanson, Gunnar J.; McCall, W. Stephen; Markworth, Christopher J.; Hinkley, Lindsay; Jenks, Matthew; Geng, Lifeng; Lewis, Meredith; Otto, James; Pronk, Bert; Verleysen, Katleen; Hall, Steven E. Journal of Medicinal Chemistry, 2009 , vol. 52, # 14 p. 4288 - 4305

~82%

2-BROMO-4-(3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL)BENZONITRILE Structure

2-BROMO-4-(3,6,...

CAS#:908111-29-5

Literature: Jia, Jia; Xu, Qin-Chao; Li, Ri-Chen; Tang, Xi; He, Ying-Fang; Zhang, Meng-Yu; Zhang, Yuan; Xing, Guo-Wen Organic and Biomolecular Chemistry, 2012 , vol. 10, # 31 p. 6279 - 6286

~57%

2-BROMO-4-(3,6,6-TRIMETHYL-4-OXO-4,5,6,7-TETRAHYDRO-1H-INDAZOL-1-YL)BENZONITRILE Structure

2-BROMO-4-(3,6,...

CAS#:908111-29-5

Literature: Jia, Jia; Xu, Qin-Chao; Li, Ri-Chen; Tang, Xi; He, Ying-Fang; Zhang, Meng-Yu; Zhang, Yuan; Xing, Guo-Wen Organic and Biomolecular Chemistry, 2012 , vol. 10, # 31 p. 6279 - 6286

 Customs

HS Code 2933990090
Summary 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%