5-Nitro-1-(phenylmethyl)-1H-1,2,4-triazole

Base Information

Chemical Name:5-Nitro-1-(phenylmethyl)-1H-1,2,4-triazole
CAS No.:136118-55-3
Molecular Formula:C₉H₈N₄O₂
Molecular Weight:204.188
Hs Code.:
DSSTox Substance ID:DTXSID301264814

Synonyms:5-Nitro-1-(phenylmethyl)-1H-1,2,4-triazole;DTXSID301264814;136118-55-3

Suppliers and Price of 5-Nitro-1-(phenylmethyl)-1H-1,2,4-triazole

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of 5-Nitro-1-(phenylmethyl)-1H-1,2,4-triazole

Chemical Property:

XLogP3:1.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:204.06472551
Heavy Atom Count:15
Complexity:225

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1=CC=C(C=C1)CN2C(=NC=N2)[N+](=O)[O-]

Technology Process of 5-Nitro-1-(phenylmethyl)-1H-1,2,4-triazole

There total 1 articles about 5-Nitro-1-(phenylmethyl)-1H-1,2,4-triazole 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:

: 100-44-7
benzyl chloride

: 24807-55-4
3-nitro-1,2,4-triazole

: 136118-55-3
1-benzyl-5-nitro-1H-1,2,4-triazole

: 136118-61-1
4-benzyl-3-nitro-4H-1,2,4-triazole

: 136118-54-2
1-benzyl-3-nitro-1H-1,2,4-triazole

Guidance literature:: With sodium ethanolate; Yield given. Multistep reaction. Yields of byproduct given; 1) EtOH, 30 min, 2) reflux, 20 h;
DOI:10.1016/S0040-4020(01)80980-7