389625-40-5

Basic information

• Product Name: Benzoic acid, 4-(1-methyl-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)
• Synonyms: Benzoic acid, 4-(1-methyl-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)
• CAS NO: 389625-40-5
• Molecular Formula: C₁₅H₂₀O₃
• Molecular Weight: 248.3175
• Product Categories: ACIDHALIDE
• Mol File: 389625-40-5.mol

Chemical Properties

• Appearance: /
• CAS DataBase Reference: Benzoic acid, 4-(1-methyl-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)(CAS DataBase Reference)
• NIST Chemistry Reference: Benzoic acid, 4-(1-methyl-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)(389625-40-5)
• EPA Substance Registry System: Benzoic acid, 4-(1-methyl-3-oxopropyl)-, 1,1-dimethylethyl ester (9CI)(389625-40-5)

Safety Data

• Hazardous Substances Data: 389625-40-5(Hazardous Substances Data)

Upstream product

• 389625-36-9 tert-butyl 4-(3-methoxy-1-methyl-3-oxopropyl)benzoate 
• 146943-27-3 methyl 3-<4-(tert-butoxycarbonyl)phenyl>propenoate 
• 65874-27-3 4-(tert-butoxycarbonyl)benzaldehyde 
• 149325-57-5 tert-butyl 4-(3-hydroxy-1-methylpropyl)benzoate 

Downstream Products

• 150585-98-1 diethyl N-{4-[1-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoyl}-L-glutamate 
• 150586-22-4 tert-butyl 4-[1-(2-amino-4-oxo-4,7-dihydro-3H-pyrrolo[2,3-d]pyrimidin-5-yl)ethyl]benzoate 
• 389625-51-8 4-(2-bromo-1-methyl-3-oxo-propyl)-benzoic acid tert-butyl ester 

Relevant articles and documents

Pyrrolo[2,3-d]pyrimidine thymidylate synthase inhibitors: Design and synthesis of one-carbon bridge derivatives

A series of novel pyrrolo[2,3-d]pyrimidine derivatives was designed and synthesized as thymidylate synthase (TS) inhibitors. Molecular design was performed on the human TS complex model built on the basis of the reported structure of TS-deoxyuridinemonoph