2-(P-NITROPHENYL)-1,3-PROPANDIOL

Base Information

• Chemical Name: 2-(P-NITROPHENYL)-1,3-PROPANDIOL
• CAS No.: 91748-03-7
• Molecular Formula: C9H11NO4
• Molecular Weight: 197.191
• Mol file: 91748-03-7.mol

Synonyms:RARECHEM AL BD 1252;2-(P-NITROPHENYL)-1,3-PROPANDIOL;2-(4-nitrophenyl)propane-1,3-diol

Chemical Property of 2-(P-NITROPHENYL)-1,3-PROPANDIOL

Chemical Property:

• PSA: 86.28000
• LogP: 1.18620

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 2-(P-NITROPHENYL)-1,3-PROPANDIOL

There total 11 articles about 2-(P-NITROPHENYL)-1,3-PROPANDIOL 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%

2-(4-nitrophenyl)malonic acid dimethyl ester (4033-88-9) → 1,3-dihydroxy-2-(4-nitrophenyl)propane (91748-03-7)

Guidance literature:

With methanol; sodium tetrahydroborate; for 3h; Reflux; Industrial scale;

Reference yield: 65.0%

diethyl 2-(4-Nitrophenyl)malonate (10565-13-6) → 1,3-dihydroxy-2-(4-nitrophenyl)propane (91748-03-7)

Guidance literature:

With diisobutylaluminium hydride; In diethyl ether; at -78 - 20 ℃;

DOI:10.1021/ja0382361

Reference yield: 26.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 1-methyl-4-nitrobenzene (99-99-0) → 2-(4-nitrophenyl)ethanol (100-27-6) + 2-(4-nitrophenyl)prop-2-en-1-ol (15121-86-5) + 1,3-dihydroxy-2-(4-nitrophenyl)propane (91748-03-7) + 2-(hydroxymethyl)-2-(4-nitrophenyl)-1,3-propanediol (91748-04-8)

Guidance literature:

With tetraethylammonium tosylate; In N,N-dimethyl-formamide; for 3.6h; Ambient temperature; electroreduction;

DOI:10.1021/jo00366a012

upstream raw materials:

formaldehyd

1-methyl-4-nitrobenzene

1,3-diacetoxy-2-(4-nitrophenyl)propane

diethyl 2-(4-Nitrophenyl)malonate

Downstream raw materials:

Acetic acid (R)-3-hydroxy-2-(4-nitro-phenyl)-propyl ester

N-isobutyl-4-(2,2,3,3,9,9,10,10-octamethyl-4,8-dioxa-3,9-disilaundecan-6-yl)aniline

4-(2,2,3,3,9,9,10,10-octamethyl-4,8-dioxa-3,9-disilaundecan-6-yl)aniline

2,2,3,3,9,9,10,10-octamethyl-6-(4-nitrophenyl)-4,8-dioxa-3,9-disilaundecane

Refernces

• 1、 -. "Niraparib important intermediate and enzymatic synthesis method thereof". Paragraph 0024. . Retrieved 2020/05/08.
• 2、 Tudge, Matthew,Mashima, Hiroko,Savarin, Cecile,Humphrey, Guy,Davies, Ian. "Facile reduction of malonate derivatives using NaBH4/Br2: an efficient route to 1,3-diols". . p. 1041 - 1044. Retrieved 2008/09/17.