5-(Aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide

Base Information

Chemical Name:5-(Aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide
CAS No.:119643-82-2
Molecular Formula:C₉H₁₀N₄O₄
Molecular Weight:238.203
Hs Code.:
UNII:YW6FGD83AT
DSSTox Substance ID:DTXSID00152538
Nikkaji Number:J396.651H
Wikidata:Q83019195
Mol file:119643-82-2.mol

Synonyms:5-(aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide;AHNB

Suppliers and Price of 5-(Aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 6 raw suppliers

Chemical Property of 5-(Aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide

Chemical Property:

Vapor Pressure:6.93E-08mmHg at 25°C
Boiling Point:422.3°Cat760mmHg
Flash Point:209.2°C
PSA：125.17000
Density:1.707g/cm³
LogP:1.86020
XLogP3:-0.4
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:238.07020481
Heavy Atom Count:17
Complexity:327

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1CN1C2=C(C=C(C(=C2)C(=O)N)[N+](=O)[O-])NO

Technology Process of 5-(Aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide

There total 4 articles about 5-(Aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide 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:

: 21919-05-1
tretazicar

: 119643-82-2
5-(aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide

: 5-(aziridin-1-yl)-2-hydroxylamino-4-nitrobenzamide

Guidance literature:: tretazicar; With potassium carbonate; In methanol; at 60 ℃;

With dihydroxyacetone; In methanol; at 60 ℃; for 0.25h;

Reference yield:

: 21919-05-1
tretazicar

: 4-amino metabolite

: 61837-26-1
2-amino-5-(aziridin-1-yl)-4-nitrobenzamide

: 119643-82-2
5-(aziridin-1-yl)-4-hydroxylamino-2-nitrobenzamide

: 5-(aziridin-1-yl)-2-hydroxylamino-4-nitrobenzamide

Guidance literature:: With His₆-tagged Staphylococcus saprophyticus DSM 20229/ATCC 15305 nitroreductase; O^5'-phosphono-riboflavin; NADPH; In dimethyl sulfoxide; at 15 ℃; pH=7; Temperature; Kinetics; aq. phosphate buffer; Enzymatic reaction;
DOI:10.1016/j.bmc.2012.04.004