4-(Dimethylamino)benzohydrazide

Base Information

• Chemical Name: 4-(Dimethylamino)benzohydrazide
• CAS No.: 19353-92-5
• Molecular Formula: C9H13N3O
• Molecular Weight: 179.222
• Hs Code.: 2928000090
• European Community (EC) Number: 242-985-1
• NSC Number: 219987
• UNII: ZW4RGK8W5Z
• DSSTox Substance ID: DTXSID90172962
• Nikkaji Number: J242.780J
• Wikidata: Q72468847
• ChEMBL ID: CHEMBL3091865
• Mol file: 19353-92-5.mol

Synonyms:4-(dimethylamino)benzohydrazide;19353-92-5;4-Dimethylaminobenzhydrazide;4-(Dimethylamino)benzhydrazide;p-(Dimethylamino)benzohydrazide;4-(N,N-Dimethylamino)benzhydrazide;4-Dimethylaminobenzohydrazide;EINECS 242-985-1;NSC-219987;Benzoic acid, 4-(dimethylamino)-, hydrazide;NSC219987;4Me2NPhCON2;Maybridge1_002636;ZW4RGK8W5Z;DivK1c_001388;SCHEMBL963723;CHEMBL3091865;HMS548P18;4-(Dimethylamino)benzoylhydrazide;4-(Dimethylamino)benzoylhydrazine;DTXSID90172962;p-(Dimethylamino)benzoyl hydrazide;AMY15241;4-Dimethylaminobenzoic acid hydrazide;BBL008425;MFCD00014761;STK044298;4-(Dimethylamino)benzenecarbohydrazide;4-Dimethylaminobenzoic acid, hydrazide;AKOS000265365;4-(dimethylamino) benzenecarbohydrazide;BS-3969;NSC 219987;p-(Dimethylamino)benzoic acid hydrazide;4-(N,N-Dimethylamino)benzoic hydrazide;CDS1_000348;CD 01774;Benzoic acid, p-(dimethylamino)-, hydrazide;CS-0205929;FT-0616760;FT-0618359;W13703;EN300-3452336;A813651;4-(Dimethylamino)benzohydrazide, for HPLC derivatization

Chemical Property of 4-(Dimethylamino)benzohydrazide

Chemical Property:

• Melting Point: 174-175°C
• Refractive Index: 1.601
• PKA: 13.12±0.10(Predicted)
• PSA: 58.36000
• Density: 1.156 g/cm³
• LogP: 1.44730
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 179.105862047
• Heavy Atom Count: 13
• Complexity: 174

Purity/Quality:

98%min ^*data from raw suppliers

4-(Dimethylamino)benzohydrazide ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi,Xn
• Statements: 36/37/38-43-40-22
• Safety Statements: 26-36-36/37

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 4-(Dimethylamino)benzohydrazide

There total 15 articles about 4-(Dimethylamino)benzohydrazide 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: 95.0%

methyl 4-(N,N-dimethylamino)benzoate (1202-25-1) → 4-(dimethylamino)benzohydrazide (19353-92-5)

Guidance literature:

With hydrazine hydrate; In methanol; at 70 ℃; for 18h;

DOI:10.1021/acs.jmedchem.5b01525

Reference yield: 91.0%

ethyl p-dimethyaminolbenzoate (10287-53-3) → 4-(dimethylamino)benzohydrazide (19353-92-5)

Guidance literature:

With hydrazine hydrate; In ethanol; for 12h; Reflux; Inert atmosphere; Schlenk technique;

DOI:10.1016/j.tetlet.2018.01.047

Reference yield: 89.4%

p-Dimethylamino-thiolbenzoesaeure-methylester-methoiodid (21176-99-8) → 4-(dimethylamino)benzohydrazide (19353-92-5)

Guidance literature:

With hydrazine hydrate; for 5h; Heating;

DOI:10.1007/BF00766459

upstream raw materials:

methyl 4-(N,N-dimethylamino)benzoate

p-Dimethylamino-thiolbenzoesaeure-methylester-methoiodid

S-methyl 4-(dimethylamino)benzothioate

N-Boc-N'-[4-(N,N-dimethylamino)benzoyl]hydrazine

Downstream raw materials:

3-(p-dimethylamino)phenyl-4-phenyl-5-(2-pyridyl)-1,2,4-triazole

2-[(4-Dimethylamino-benzoyl)-hydrazono]-5,5-dimethyl-4-oxo-hexanoic acid methyl ester

N-4-(dimethylamino)benzamido-N'-1-naphthylthiourea

N-4-(dimethylamino)benzamido-N'-1-naphthylurea

Refernces

• 1、 Khelladi, Mustapha,Leclerc, Nicolas,Jacquemin, Denis,De Nicola, Antoinette,Ulrich, Gilles. "Synthesis and spectral properties of non-symmetrical red and near IR emitter dibenzoBODIPYs". . p. 878 - 881. Retrieved 2018.
• 2、 Liu, Jie,Zhang, Guang-Yu,Zhang, Zhe,Li, Bo,Chai, Fei,Wang, Qi,Zhou, Zi-Dan,Xu, Ling-Ling,Wang, Shou-Kai,Jin, Zhen,Tang, You-Zhi. "Design, synthesis, in vitro and in vivo evaluation against MRSA and molecular docking studies of novel pleuromutilin derivatives bearing 1, 3, 4-oxadiazole linker". . . Retrieved 2021/05/17.
• 3、 Wang, Zhi-Gang,Ding, Xiao-Jing,Huang, Yu-Ying,Yan, Xiao-Jing,Ding, Bin,Li, Qing-Zhong,Xie, Cheng-Zhi,Xu, Jing-Yuan. "The development of coumarin Schiff base system applied as highly selective fluorescent/colorimetric probes for Cu2+ and tumor biomarker glutathione detection". . . Retrieved 2019/12/26.