N-Formyl-DL-alanine

Base Information

• Chemical Name: N-Formyl-DL-alanine
• CAS No.: 5893-10-7
• Molecular Formula: C4H7 N O3
• Molecular Weight: 117.104
• Hs Code.: 2924199090
• European Community (EC) Number: 227-574-7
• NSC Number: 6749
• Mol file: 5893-10-7.mol

Synonyms:N-Formyl-DL-alanine;2-formamidopropanoic acid;5893-10-7;2-(formylamino)propanoic acid;N-Formylalanine;DL-Alanine, N-formyl-;N-Formylalanine #;2-Formylamino-propionic acid;Formyl-Ala-OH;N-formyl-d,l-alanine;2-Formylaminopropanoic acid;SCHEMBL697886;NSC6749;NSC-6749;MFCD00063285;STK502891;AKOS001024047;AKOS016342109;HY-W141838;N-Formyl-DL-alanine (For-DL-Ala-OH);NCGC00339440-01;AS-58520;BB 0240768;CS-0201634;F0107;FT-0654745;FT-0656026;EN300-174129;T72666;AB01332328-02;A832080;Z56757230;N-(3-ethoxypropyl)-5-[(4-hexylbenzoyl)amino]-2-pyrrolidin-1-yl-benzamide

Chemical Property of N-Formyl-DL-alanine

Chemical Property:

• Vapor Pressure: 7.11E-14mmHg at 25°C
• Melting Point: 150°C
• Boiling Point: 386.6°Cat760mmHg
• Flash Point: 187.6°C
• PSA: 66.40000
• Density: 1.223g/cm³
• LogP: 0.23230
• XLogP3: -0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 117.042593085
• Heavy Atom Count: 8
• Complexity: 102

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-FormamidopropanoicAcid ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C(=O)O)NC=O

Technology Process of N-Formyl-DL-alanine

There total 16 articles about N-Formyl-DL-alanine 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: 98.0%

formic acid (64-18-6) + L-alanin (56-41-7,25191-17-7,18875-37-1) → (S)-2-formamidopropanoic acid (5893-10-7,10512-86-4,42918-85-4)

Guidance literature:

With acetic anhydride; at 0 - 20 ℃;

DOI:10.1039/c7ob01715d

Reference yield: 92.0%

formic acid (64-18-6) + rac-Ala-OH (302-72-7,25191-17-7,18875-37-1) → N-formylalanine (5893-10-7)

Guidance literature:

formic acid; With silica gel; at 20 ℃; for 0.0166667h;

rac-Ala-OH; With silica gel; at 110 ℃; for 0.0666667h;

Reference yield: 90.0%

rac-Ala-OH (302-72-7,25191-17-7,18875-37-1) + formic acid ethyl ester (109-94-4) → N-formylalanine (5893-10-7)

Guidance literature:

With sulfonic acid supported on polydopamine (PDA)-encapsulated Fe₃O₄ nanoparticles; In neat (no solvent); at 40 ℃; for 2h; Green chemistry;

DOI:10.1039/c7nj00417f

upstream raw materials:

formic acid

rac-Ala-OH

formyl acetic anhydride

Oxalacetic acid

Downstream raw materials:

3-formylamino-butan-2-one

N-formyl-L-alanine 4-nitrophenyl ester

2-Isocyan-N-<(S)-1'-phenylethyl>propionsaeureamid

rac-Ala-OH

Refernces

• 1、 Serafini, Marta,Griglio, Alessia,Viarengo, Sara,Aprile, Silvio,Pirali, Tracey. "An aryne-based three-component access to α-aroylamino amides". . p. 6604 - 6612. Retrieved 2017/08/16.
• 2、 Odriozola, Amaiur,Oiarbide, Mikel,Palomo, Claudio. "Enantioselective Synthesis of Quaternary Δ4- and Δ5-Dehydroprolines Based on a Two-Step Formal [3+2] Cycloaddition of α-Aryl and α-Alkyl Isocyano(thio)acetates with Vinyl Ketones". supporting information. p. 12758 - 12762. Retrieved 2017/09/25.