749921-33-3

Basic information

• Product Name: Pentanoic acid, 3-[[4-(trifluoromethyl)phenyl]amino]-, methyl ester, (3R)-
• CAS NO: 749921-33-3
• Molecular Formula: C13H16F3NO2
• Molecular Weight: 275.271
• Mol File: 749921-33-3.mol
• Article Data: 4

Chemical Properties

• CAS DataBase Reference: Pentanoic acid, 3-[[4-(trifluoromethyl)phenyl]amino]-, methyl ester, (3R)-(CAS DataBase Reference)
• NIST Chemistry Reference: Pentanoic acid, 3-[[4-(trifluoromethyl)phenyl]amino]-, methyl ester, (3R)-(749921-33-3)
• EPA Substance Registry System: Pentanoic acid, 3-[[4-(trifluoromethyl)phenyl]amino]-, methyl ester, (3R)-(749921-33-3)

Safety Data

• Hazardous Substances Data: 749921-33-3(Hazardous Substances Data)

Upstream product

• 1027896-34-9 (R)-4-ethyl-1-[4-(trifluoromethyl)phenyl]-2-azetidinone 
• 124-41-4 sodium methylate 
• 749921-32-2 methyl 3-(4-trifluoromethylphenylamino)-2-pentenoate 
• 455-14-1 4-trifluoromethylphenylamine 
• 30414-53-0 methyl propanoyl acetate 
• 67-56-1 methanol 
• 192379-68-3 3-(trans-2'-pentenoyl)oxazolidin-2-one 

Downstream Products

• 667937-05-5 (3R)-3-(4-trifluoromethylphenylamino)pentanoic acid amide 

Relevant articles and documents

PROCESS FOR PRODUCING AMINO ACID DERIVATIVES

The present invention relates to a process for producing amino acid derivatives such as optically active β-amino acid in short steps with good yield and high optical purity, which comprises reacting a keto acid of the formula (1): wherein R1 is hydrogen, an optionally substituted hydrocarbon, etc.; R2 is a spacer; and R3 is an optionally substituted alkoxy, etc., or a salt thereof, with ammonia or an amine or a salt thereof in the presence of a chiral catalyst and in the presence or absence of an acid and/or a fluorine-containing alcohol, to give an amino acid derivative of the formula (2): wherein Q is a group formed by removing one hydrogen atom from ammonia or an amine; X' is an acid and/or a fluorine-containing alcohol; and b is 0 or 1.

METHOD FOR PRODUCING AN OPTICALLY ACTIVE TETRAHYDROQUINOLINE

The present invention provides an industrially advantageous production method of optically active tetrahydroquinolines of formula (1), which comprises: 1) a step of reacting a β-ketoester of formula (2) with an amine of formula (3) to produce an enaminoester of formula (4); 2) a step of subjecting the enaminoester of formula (4) above obtained in 1) to asymmetric hydrogenation to produce an optically active β-amino acid derivative of formula (5); 3) a step of amidating the optically active β-amino acid derivative (5) above obtained in 2) to produce an amide of formula (6); 4) step of alkoxycarbonylating the amide of formula (6) above obtained in 3) to produce a compound of formula (7); and 5) a step of subjecting the compound of formula (7) above to cyclization to produce the optically active tetrahydroquinoline of formula (1).