2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid

Base Information

• Chemical Name: 2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid
• CAS No.: 3850-40-6
• Molecular Formula: C8H15 N O5
• Molecular Weight: 205.211
• Hs Code.: 2924199090
• European Community (EC) Number: 827-118-2
• NSC Number: 164056
• Nikkaji Number: J2.090.782G
• Mol file: 3850-40-6.mol

Synonyms:3850-40-6;2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid;N-BOC-DL-SERINE;Boc-L-serine;N-Boc-D-serine;3-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid;2-{[(tert-butoxy)carbonyl]amino}-3-hydroxypropanoic acid;Boc-Serine;Boc-DL-Ser-OH;MFCD00063142;Boc-DL-serine;N-boc-d1-serine;NSC164056;(tert-butoxycarbonyl)serine;(R)-2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid;SCHEMBL47290;HOCH2CH(NH-t-Boc)COOH;2-tert-Butoxycarbonylamino-3-hydroxy-propionic acid;FHOAKXBXYSJBGX-UHFFFAOYSA-N;N-(tert-butoxycarbonyl)-DL-serine;MFCD00190830;L-Serine,1-dimethylethoxy)carbonyl]-;AKOS000179496;AKOS016339562;AB01639;NSC-164056;SY033562;CS-0166812;FT-0634752;FT-0650105;EN300-72109;8P-058;F16496;A873828;2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoicacid;N-(4-(N-(2-(Phenylamino)phenyl)sulfamoyl)phenyl)acetamide

Chemical Property of 2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid

Chemical Property:

• Boiling Point: 385.1±37.0 °C(Predicted)
• PKA: 3.62±0.10(Predicted)
• PSA: 95.86000
• Density: 1.240±0.06 g/cm3(Predicted)
• LogP: 0.34750
• Storage Temp.: 2-8°C
• XLogP3: -0.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 205.09502258
• Heavy Atom Count: 14
• Complexity: 220

Purity/Quality:

97% ^*data from raw suppliers

2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoicAcid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)OC(=O)NC(CO)C(=O)O

Technology Process of 2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid

There total 14 articles about 2-((tert-Butoxycarbonyl)amino)-3-hydroxypropanoic acid 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: 100.0%

D-Serine (312-84-5,83245-15-2) + di-tert-butyl dicarbonate (24424-99-5) → (R)-N-tert-butoxycarbonyl serine (3262-72-4,3850-40-6,6368-20-3,90582-28-8,84311-18-2)

Guidance literature:

With sodium hydroxide; In 1,4-dioxane; water; at 0 - 25 ℃; for 2h;

DOI:10.1021/ja00097a072

Reference yield: 99.0%

D-Serine (312-84-5,83245-15-2) → (R)-N-tert-butoxycarbonyl serine (3262-72-4,3850-40-6,6368-20-3,90582-28-8,84311-18-2)

Guidance literature:

With di-tert-butyl dicarbonate; sodium hydroxide; In 1,4-dioxane; water; at 0 - 20 ℃; for 7h;

DOI:10.1002/chem.201801868

Reference yield: 94.7%

serin (302-84-1,83245-15-2) + di-tert-butyl dicarbonate (24424-99-5) → N-Boc-DL-serine (3850-40-6)

Guidance literature:

With sodium hydroxide; In water; at 0 - 27 ℃;

upstream raw materials:

D-Serine

di-tert-butyl dicarbonate

2-(tert-Butoxycarbonyloxyimino)-2-phenylacetonitrile

(2R)-2-amino-3-hydroxypropanoic acid hydrochloride

Downstream raw materials:

2,4-Dinitrophenylester von BOC-D-Serin

2-(tert-butoxycarbonylamino)-3-hydroxypropionic acid methyl ester

Boc-D-Ser-D-Ala-OBzl

(S)-2-((R)-2-tert-Butoxycarbonylamino-3-hydroxy-propionylamino)-hex-5-enoic acid benzyl ester