4-Chlorobenzoic acid 2-(((2-chloroethyl)nitrosoamino)carbonyl)hydrazide

Base Information

• Chemical Name: 4-Chlorobenzoic acid 2-(((2-chloroethyl)nitrosoamino)carbonyl)hydrazide
• CAS No.: 147217-65-0
• Molecular Formula: C₁₀H₁₀Cl₂N₄O₃
• Molecular Weight: 305.12
• DSSTox Substance ID: DTXSID20933068
• Nikkaji Number: J516.295E
• Wikidata: Q82908861
• Mol file: 147217-65-0.mol

Synonyms:4-Chlorobenzoic acid 2-(((2-chloroethyl)nitrosoamino)carbonyl)hydrazide;147217-65-0;4-(4-Chlorobenzoyl)-1-(2-chloroethyl)-1-nitrosohydrazine carboxamide;Benzoic acid, 4-chloro-, 2-(((2-chloroethyl)nitrosoamino)carbonyl)hydrazide;C10H10Cl2N4O3;DTXSID20933068;C10-H10-Cl2-N4-O3;LS-36415;1-Oxo-2-(2-chloroethyl)-5-(4-chlorobenzoyl)carbonohydrazide;N'-(4-Chlorobenzoyl)-N-(2-chloroethyl)-N-nitrosocarbamohydrazonic acid

Chemical Property of 4-Chlorobenzoic acid 2-(((2-chloroethyl)nitrosoamino)carbonyl)hydrazide

Chemical Property:

• Density: 1.52g/cm³
• XLogP3: 2.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 304.0129956
• Heavy Atom Count: 19
• Complexity: 335

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC=C1C(=O)NNC(=O)N(CCCl)N=O)Cl

Technology Process of 4-Chlorobenzoic acid 2-(((2-chloroethyl)nitrosoamino)carbonyl)hydrazide

There total 1 articles about 4-Chlorobenzoic acid 2-(((2-chloroethyl)nitrosoamino)carbonyl)hydrazide 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: 81.0%

N1-(2-chloroethyl)-N1-nitrosocarbamoyl azide (60784-40-9) + 4-chlorobenzoic acid hydrazide (536-40-3) → 4-(4-chlorobenzoyl)-1-(2-chloroethyl)1-nitrosohydrazinecarboxamide (147217-65-0)

Guidance literature:

With pyridine; at 0 ℃;

DOI:10.1016/0223-5234(92)90109-E

upstream raw materials:

N₁-(2-chloroethyl)-N₁-nitrosocarbamoyl azide

4-chlorobenzoic acid hydrazide