Methyl 2-amino-2-benzyl-3,3-difluoropropanoate

Base Information

Chemical Name:Methyl 2-amino-2-benzyl-3,3-difluoropropanoate
CAS No.:167612-40-0
Molecular Formula:C₁₁H₁₃F₂NO₂
Molecular Weight:229.227
Hs Code.:
DSSTox Substance ID:DTXSID501256441

Synonyms:methyl 2-amino-2-benzyl-3,3-difluoropropanoate;167612-40-0;SCHEMBL2213529;DTXSID501256441;I+/--(Difluoromethyl)phenylalanine methyl ester

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Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of Methyl 2-amino-2-benzyl-3,3-difluoropropanoate

Chemical Property:

XLogP3:1.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:229.09143498
Heavy Atom Count:16
Complexity:242

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC(=O)C(CC1=CC=CC=C1)(C(F)F)N

Technology Process of Methyl 2-amino-2-benzyl-3,3-difluoropropanoate

There total 5 articles about Methyl 2-amino-2-benzyl-3,3-difluoropropanoate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

: 70471-12-4
2-Benzyl-3,3-difluoro-2-{[1-phenyl-meth-(Z)-ylidene]-amino}-propionic acid methyl ester

: 167612-40-0
H-(α-CF2H)Phe-OMe

Guidance literature:: With hydrogenchloride; In diethyl ether;
DOI:10.1021/jo01329a029

Reference yield:

: 2577-90-4
methyl (2S)-2-amino-3-phenylpropanoate

: 167612-40-0
H-(α-CF2H)Phe-OMe

Guidance literature:: Multi-step reaction with 3 steps

1.1: LDA / tetrahydrofuran / -78 °C

1.2: tetrahydrofuran

2.1: aq. HCl / 20 °C

With hydrogenchloride; lithium diisopropyl amide; In tetrahydrofuran;
DOI:10.1021/jm0511334

Reference yield:

: 68870-85-9,120408-13-1,137693-23-3,40216-77-1
(S)-2-(benzylidene-amino)-3-phenyl-propionic acid methyl ester

: 167612-40-0
H-(α-CF2H)Phe-OMe

Guidance literature:: Multi-step reaction with 2 steps

1.1: LDA / tetrahydrofuran / -78 °C

1.2: tetrahydrofuran

2.1: aq. HCl / 20 °C

With hydrogenchloride; lithium diisopropyl amide; In tetrahydrofuran;
DOI:10.1021/jm0511334