[(E)-[(4-methoxyphenyl)methylidene]amino]urea

Base Information

• Chemical Name: [(E)-[(4-methoxyphenyl)methylidene]amino]urea
• CAS No.: 6292-71-3
• Molecular Formula: C9H11 N3 O2
• Molecular Weight: 193.2
• Hs Code.: 2928000090
• NSC Number: 634798,9930
• ChEMBL ID: CHEMBL307867
• Mol file: 6292-71-3.mol

Synonyms:4-Methoxybenzaldehyde semicarbazone;[(E)-[(4-methoxyphenyl)methylidene]amino]urea;6292-71-3;120445-53-6;NSC634798;[(E)-(4-methoxyphenyl)methylideneamino]urea;p-methoxy-phenylsemicarbazone;CHEMBL307867;SCHEMBL17560738;NSC9930;NSC-9930;MFCD00456389;STL263341;AKOS003544900;NSC-634798;4-Methoxybenzaldehyde semicarbazone, 97%;(E)-1-(4-Methoxybenzylidene)semicarbazide;[(E)-(4-methoxyphenyl)methyleneamino]urea;4-METHOXYBENZALDEHYDE SEMICARBAZONE 97;(2E)-2-(4-methoxybenzylidene)hydrazinecarboxamide;12L-722;Hydrazinecarboxamide, 2-[(4-methoxyphenyl)methylene]-, (2E)-

Chemical Property of [(E)-[(4-methoxyphenyl)methylidene]amino]urea

Chemical Property:

• Melting Point: 203-207 °C(lit.)
• PSA: 76.71000
• Density: 1.22g/cm³
• LogP: 1.78860
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 193.085126602
• Heavy Atom Count: 14
• Complexity: 210

Purity/Quality:

99% ^*data from raw suppliers

4-Methoxybenzaldehyde semicarbazone Aldrich ^*data from reagent suppliers

Safty Information:

• Safety Statements: 22-24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)C=NNC(=O)N
• Isomeric SMILES: COC1=CC=C(C=C1)/C=N/NC(=O)N

Technology Process of [(E)-[(4-methoxyphenyl)methylidene]amino]urea

There total 8 articles about [(E)-[(4-methoxyphenyl)methylidene]amino]urea 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%

semicarbazide hydrochloride (563-41-7) + 4-methoxy-benzaldehyde (123-11-5) → 4-methoxybenzaldehyde semicarbazone (6292-71-3,120445-53-6)

Guidance literature:

With sodium acetate; In ethanol; water; at 20 ℃;

DOI:10.1016/j.bioorg.2018.03.029

Reference yield:

4-methoxy-benzaldehyde (123-11-5) + hydrazine carboxamide (4426-72-6,51433-48-8,57-56-7) → 4-methoxybenzaldehyde semicarbazone (6292-71-3,120445-53-6)

Guidance literature:

Reference yield:

N4-semicarbazide hydrochloride + 4-methoxy-benzaldehyde (123-11-5) → 4-methoxybenzaldehyde semicarbazone (6292-71-3,120445-53-6)

Guidance literature:

With sodium acetate; In methanol; water;

DOI:10.1016/j.molstruc.2020.129742

upstream raw materials:

semicarbazide hydrochloride

4-methoxy-benzaldehyde

4-methoxybenzylidene thiosemicarbazone

dihydrogen peroxide

Downstream raw materials:

4-methoxybenzaldehydephenylhydrazone

N,N-bis(4-methoxybenzylidene)hydrazine

5-(4-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazol-3-one

4-methoxy-benzaldehyde

Refernces

• 1、 Naclerio, George A.,Abutaleb, Nader S.,Li, Daoyi,Seleem, Mohamed N.,Sintim, Herman O.. "Ultrapotent Inhibitor of Clostridioides difficile Growth, Which Suppresses Recurrence in Vivo". . p. 11934 - 11944. Retrieved 2020/11/26.
• 2、 da Cruz, Anne Cecília Nascimento,Brondani, Dalci José,de Santana, Temístocles I′Talo,da Silva, Lucas Oliveira,Borba, Elizabeth Fernanda da Oliveira,de Faria, Ant?nio Rodolfo,de Albuquerque, Julianna Ferreira Cavalcanti,Piessard, Sylvie,Ximenes, Rafael Matos,Baratte, Blandine,Bach, Stéphane,Ruchaud, Sandrine,Mendon?a Junior, Francisco Jaime Bezerra,Bazin, Marc-Antoine,Rabello, Marcelo Montenegro,Hernandes, Marcelo Zaldini,Marchand, Pascal,da Silva, Teresinha Gon?alves. "Biological evaluation of arylsemicarbazone derivatives as potential anticancer agents". . . Retrieved 2019/11/25.