3-Aminobenzhydrazide

Base Information

• Chemical Name: 3-Aminobenzhydrazide
• CAS No.: 14062-34-1
• Molecular Formula: C7H9 N3 O
• Molecular Weight: 151.168
• Hs Code.: 2928000090
• European Community (EC) Number: 237-907-8
• NSC Number: 28878
• UNII: 459AL52KFJ
• DSSTox Substance ID: DTXSID4074516
• Nikkaji Number: J141.309K
• Wikidata: Q82002835
• ChEMBL ID: CHEMBL125641
• Mol file: 14062-34-1.mol

Synonyms:3-Aminobenzhydrazide;3-Aminobenzohydrazide;14062-34-1;3-Aminobenzoyl hydrazine;m-Aminobenzohydrazide;m-Aminobenzhydrazide;m-Amino benzhydrazide;Benzoic acid, 3-amino-, hydrazide;m-Aminobenzoic acid hydrazide;3-aminobenzoic acid hydrazide;459AL52KFJ;C7-H9-N3-O;EINECS 237-907-8;NSC-28878;3-Amino-benzoic acid hydrazide;3-Aminobenzohydrazide #;UNII-459AL52KFJ;3-AMINOBENZOYLHYDRAZIDE;SCHEMBL294944;3-Aminobenzoic acid, hydrazide;M-AMINOBENZOIC HYDRAZIDE;CHEMBL125641;DTXSID4074516;NSC28878;MFCD00017067;NSC 28878;AKOS008966956;AS-61578;CS-0206379;FT-0615025;EN300-17375;E85335;Z56922179

Chemical Property of 3-Aminobenzhydrazide

Chemical Property:

• Melting Point: 91-92°C
• Boiling Point: °Cat760mmHg
• PKA: 12.48±0.10(Predicted)
• Flash Point: °C
• PSA: 81.14000
• Density: 1.267g/cm³
• LogP: 1.54470
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 151.074561919
• Heavy Atom Count: 11
• Complexity: 149

Purity/Quality:

99% ^*data from raw suppliers

3-Aminobenzhydrazide ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)N)C(=O)NN

Technology Process of 3-Aminobenzhydrazide

There total 4 articles about 3-Aminobenzhydrazide 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: 72.0%

3-aminobenzoic acid ethyl ester (582-33-2) → 3-aminobenzohydrazide (14062-34-1)

Guidance literature:

With hydrazine hydrate; In ethanol; water; Reflux;

DOI:10.1016/j.bmc.2015.06.051

Reference yield: 67.93%

→ 3-aminobenzohydrazide (14062-34-1)

Guidance literature:

With hydrazine hydrate; In ethanol; at 25 ℃; for 2h;

Reference yield:

Methyl 3-aminobenzoate (4518-10-9) → 3-aminobenzohydrazide (14062-34-1)

Guidance literature:

With hydrazine hydrate; In methanol; at 80 ℃; for 19h;

upstream raw materials:

3-aminobenzoic acid ethyl ester

meta-aminobenzoic acid

Methyl 3-aminobenzoate

Downstream raw materials:

m-aminobenzaldehyde

5-(3-amino-phenyl)-3H-[1,3,4]oxadiazol-2-one

Refernces

• 1、 Zhou, Wenjuan,Xu, Chenhao,Dong, Guanjun,Qiao, Hui,Yang, Jing,Liu, Hongmin,Ding, Lina,Sun, Kai,Zhao, Wen. "Development of phenyltriazole thiol-based derivatives as highly potent inhibitors of DCN1-UBC12 interaction". . . Retrieved 2021/03/24.
• 2、 Sultan, Sadaf,Ashiq, Uzma,Jamal, Rifat Ara,Mahroof-Tahir, Mohammad,Ahmad, Rao Saeed,Shaikh, Zara. "Tyrosinase and carbonic anhydrase enzymes inhibition studies of vanadium(V) complexes". . . Retrieved 2018/06/06.