4-NITROTOLUENE-D7

Base Information

• Chemical Name: 4-NITROTOLUENE-D7
• CAS No.: 84344-19-4
• Molecular Formula: C7D7NO2
• Molecular Weight: 144.082
• Mol file: 84344-19-4.mol

Synonyms:4-NITROTOLUENE-D7;4-Methyl-1-nitrobenzene-d7;4-Nitrotoluol-d7;NSC 9579-d7;para-Nitrotoluene-d7

Chemical Property of 4-NITROTOLUENE-D7

Chemical Property:

• Melting Point: 49-52 °C
• PSA: 45.82000
• LogP: 2.42640

Purity/Quality:

95% ^*data from raw suppliers

4-Nitrotoluene-d7 ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 4-NITROTOLUENE-D7

There total 3 articles about 4-NITROTOLUENE-D7 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: 42.0%

(2)H8-toluene (2037-26-5) → 4-nitro<2,4,5,6-2H4>toluene (84344-19-4)

Guidance literature:

With sulfuric acid; nitric acid; at 5 - 25 ℃; for 4.66667h;

DOI:10.1002/jlcr.3266

Reference yield: 3.6%

(2)H8-toluene (2037-26-5) → 4-nitro<2,4,5,6-2H4>toluene (84344-19-4) + o-nitro<3,4,5,6-2H4>toluene (84344-04-7,115049-76-8)

Guidance literature:

With nitric acid; acetic anhydride; acetic acid;

DOI:10.1021/ja00274a047

Reference yield:

(2)H8-toluene (2037-26-5) → 4-nitro<2,4,5,6-2H4>toluene (84344-19-4) + o-nitro<3,4,5,6-2H4>toluene (84344-04-7,115049-76-8) + m-nitro<2,3,5,6-2H4>toluene

Guidance literature:

With nitric acid; sulfuric acid-d2; In water-d2; for 1.5h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1002/jlcr.2580361010

upstream raw materials:

⁽²⁾H₈-toluene

Downstream raw materials:

2-chloro-p-nitrotoluene-d₆

4-aminobenzoic-2,3,5,6-d₄ acid

4-[3,5-bis(2-hydroxyphenyl)-1H-1,2,4-triazol-1-yl]-[2,3,5,6-²H₄]benzoic acid

4-nitro<2,3,5,6-2H4>benzoic acid

Refernces

• 1、 Saleh, Hesham,Petras, Daniel,Mainz, Andi,Kerwat, Dennis,Nalbantsoy, Ayse,Erzurumlu, Yalcin,Süssmuth, Roderich D.. "Deuterium-Labeled Precursor Feeding Reveals a New pABA-Containing Meroterpenoid from the Mango Pathogen Xanthomonas citri pv. mangiferaeindicae". supporting information. p. 1532 - 1537. Retrieved 2016/07/06.
• 2、 -. "DEUTERATED HETEROCYCLIC INHIBITORS OF NECROPTOSIS". Page/Page column 26. . Retrieved 2014/10/04.