N-BOC-D/L-ALANINOL

Base Information

• Chemical Name: N-BOC-D/L-ALANINOL
• CAS No.: 147252-84-4
• Molecular Formula: C₈H₁₇NO₃
• Molecular Weight: 175.228
• Hs Code.: 2924199090
• Mol file: 147252-84-4.mol

Synonyms:(2-Hydroxy-1-methylethyl)carbamic acid tert-butyl ester;Carbamicacid, (2-hydroxy-1-methylethyl)-, 1,1-dimethylethyl ester (9CI);tert-Butyl (1-hydroxypropan-2-yl)carbamate;N-Boc-DL-2-amino-1-propanol;

Chemical Property of N-BOC-D/L-ALANINOL

Chemical Property:

• Vapor Pressure: 0.000597mmHg at 25°C
• Melting Point: 52-59 °C
• Refractive Index: 1.45
• Boiling Point: 276.4 °C at 760 mmHg
• PKA: 12.11±0.46(Predicted)
• Flash Point: 121 °C
• PSA: 58.56000
• Density: 1.025 g/cm³
• LogP: 1.28280
• Storage Temp.: 2-8°C
• Solubility.: Chloroform

Purity/Quality:

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

N-tert-Butyloxycarbonyl DL-alaninol ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F,T
• Hazard Codes: F,T
• Statements: 11-25
• Safety Statements: 45

MSDS Files:

SDS file from LookChem

Useful:

• Uses: N-BOC-D/L-ALANINOL is used in the preparation of heterocyclic compounds, as integrase inhibiting antiviral agents.

Technology Process of N-BOC-D/L-ALANINOL

There total 23 articles about N-BOC-D/L-ALANINOL 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%

(R)-2-aminopropan-1-ol (35320-23-1) + di-tert-butyl dicarbonate (24424-99-5) → (R)-2-tertbutoxycarbonylamino-1-propanol (79069-13-9,127516-56-7,147252-84-4,106391-86-0)

Guidance literature:

With triethylamine; In methanol; at 0 - 20 ℃; for 12h;

DOI:10.1016/j.ejmech.2021.113785

Reference yield: 100.0%

1-benzyloxy-2(S)-t-butoxycarbonylamino-3-ethylthiopropane (167421-97-8) → (R)-2-tertbutoxycarbonylamino-1-propanol (79069-13-9,127516-56-7,147252-84-4,106391-86-0)

Guidance literature:

nickel; In ethanol; water; Heating;

DOI:10.1016/0040-4039(95)00039-F

Reference yield: 97.0%

methyl 2-{[(tert-butoxy)carbonyl]amino}propanoate (112392-66-2) → tert-butyl (1-hydroxypropan-2-yl)carbamate (147252-84-4,79069-13-9,106391-86-0,127516-56-7)

Guidance literature:

With sodium tetrahydroborate; lithium chloride; In tetrahydrofuran; ethanol;

DOI:10.1248/cpb.37.3119

upstream raw materials:

(R)-2-aminopropan-1-ol

di-tert-butyl dicarbonate

N-(tert-butoxycarbonyl)-D-alanine methyl ester

1-benzyloxy-2(S)-t-butoxycarbonylamino-3-ethylthiopropane

Downstream raw materials:

NNC 21-0136

(R)-ethyl 4-(N-tert-butoxycarbonyl)amino 3-oxopentanoate

ethyl 4-((tert-butoxycarbonyl)amino)-3-oxopentanoate

tert-butyl ((1R)-2-{[4-formyl-1-(phenylsulfonyl)-1H-indol-5-yl]oxy}-1-methylethyl)carbamate

Refernces

• 1、 Das, Kalyan,De Jonghe, Steven,Gu, Weijie,Herdewijn, Piet,Martinez, Sergio,Nguyen, Hoai,Rozenski, Jef,Schols, Dominique,Singh, Abhimanyu K.. "Exploring the dNTP -binding site of HIV-1 reverse transcriptase for inhibitor design". . . Retrieved 2021/08/24.
• 2、 -. "HETEROCYCLIC COMPOUNDS". Paragraph 0224; 0281. . Retrieved 2020/12/29.