5-Amino-1-benzyltriazole-4-carbohydrazide

Base Information

• Chemical Name: 5-Amino-1-benzyltriazole-4-carbohydrazide
• CAS No.: 16975-91-0
• Molecular Formula: C₁₀H₁₂N₆O
• Molecular Weight: 232.245
• NSC Number: 111588
• DSSTox Substance ID: DTXSID30296797
• Wikidata: Q82037573
• Mol file: 16975-91-0.mol

Synonyms:16975-91-0;5-amino-1-benzyltriazole-4-carbohydrazide;5-amino-1-benzyl-1H-1,2,3-triazole-4-carbohydrazide;NSC111588;1h-1,2,3-triazole-4-carboxylic acid, 5-amino-1-(phenylmethyl)-, hydrazide;DTXSID30296797;NOIGRTLRFHCZFU-UHFFFAOYSA-N;STK779845;AKOS000676607;NSC-111588;5-amino-1-benzyl-triazole-4-carbohydrazide;EN300-12640533;SR-01000332192;SR-01000332192-1;5-amino-1-benzyl-1,2,3-triazole-4-carboxylic acid hydrazide

Chemical Property of 5-Amino-1-benzyltriazole-4-carbohydrazide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: 1.52g/cm³
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 3
• Exact Mass: 232.10725903
• Heavy Atom Count: 17
• Complexity: 268

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C(=C(N=N2)C(=O)NN)N

Technology Process of 5-Amino-1-benzyltriazole-4-carbohydrazide

There total 3 articles about 5-Amino-1-benzyltriazole-4-carbohydrazide 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%

1-benzyl-5-amino-1,2,3-triazole-4-carboxylic acid ethyl ester (20271-33-4) → 5-Amino-1-benzyl-1,2,3-triazole-4-carboxylic Acid Hydrazide (16975-91-0)

Guidance literature:

With hydrazine hydrate;

DOI:10.1007/BF00956825

Reference yield: 67.0%

5-Amino-1-benzyl-4,5-dihydro-1,2,3-triazolo<4,5-d>pyrimidin-4-one (104699-70-9) → 5-Amino-1-benzyl-1,2,3-triazole-4-carboxylic Acid Hydrazide (16975-91-0)

Guidance literature:

With sulfuric acid; for 1h;

DOI:10.1002/jhet.5570220563

Reference yield:

benzyl azide (622-79-7) → 5-Amino-1-benzyl-1,2,3-triazole-4-carboxylic Acid Hydrazide (16975-91-0)

Guidance literature:

Multi-step reaction with 2 steps

1: 53 percent / Na / ethanol / 48 h / 20 °C / 3750300 Torr

2: 95 percent / NH₂NH₂*H₂O

With sodium; hydrazine hydrate; In ethanol;

DOI:10.1007/BF00956825

upstream raw materials:

1-benzyl-5-amino-1,2,3-triazole-4-carboxylic acid ethyl ester

5-Amino-1-benzyl-4,5-dihydro-1,2,3-triazolo<4,5-d>pyrimidin-4-one

benzyl azide

Downstream raw materials:

5-Amino-1-benzyl-1,2,3-triazole-4-carboxylic Acid (N-2-Acetyl)hydrazide

5-Amino-1-benzyl-4,5-dihydro-1,2,3-triazolo<4,5-d>pyrimidin-4-one

2-(5-Amino-1-benzyl-1,2,3-triazol-4-yl)-5-methyl-1,3,4-oxadiazole

2-(5-Amino-1-benzyl-1,2,3-triazol-4-yl)-5-phenyl-1,3,4-oxadiazole