methyl 8-carbamoyl-4-methylidene-1H-imidazo[5,1-c][1,2,4]triazine-3-carboxylate

Base Information

Chemical Name:methyl 8-carbamoyl-4-methylidene-1H-imidazo[5,1-c][1,2,4]triazine-3-carboxylate
CAS No.:78695-87-1
Molecular Formula:C₉H₉N₅O₃
Molecular Weight:235.202
Hs Code.:
NSC Number:330468
DSSTox Substance ID:DTXSID90419526
Wikidata:Q82230558

Synonyms:78695-87-1;NSC330468;DTXSID90419526;NSC-330468;methyl 8-carbamoyl-4-methylidene-1H-imidazo[5,1-c][1,2,4]triazine-3-carboxylate

Suppliers and Price of methyl 8-carbamoyl-4-methylidene-1H-imidazo[5,1-c][1,2,4]triazine-3-carboxylate

Supply Marketing:

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

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of methyl 8-carbamoyl-4-methylidene-1H-imidazo[5,1-c][1,2,4]triazine-3-carboxylate

Chemical Property:

Vapor Pressure:8.65E-10mmHg at 25°C
Boiling Point:491.1°C at 760 mmHg
Flash Point:250.8°C
Density:1.66g/cm³
XLogP3:0.1
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:235.07053917
Heavy Atom Count:17
Complexity:419

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:COC(=O)C1=NNC2=C(N=CN2C1=C)C(=O)N

Technology Process of methyl 8-carbamoyl-4-methylidene-1H-imidazo[5,1-c][1,2,4]triazine-3-carboxylate

There total 4 articles about methyl 8-carbamoyl-4-methylidene-1H-imidazo[5,1-c][1,2,4]triazine-3-carboxylate 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: 88.0%

: 78695-75-7
methyl 2-(4-carbamoylimidazol-5-ylhydrazono)acetoacetate

: 78695-87-1
methyl 8-carbamoyl-1,4-dihydro-4-methyleneimidazo<5,1-c><1,2,4>triazine-3-carboxylate

Guidance literature:: In ethanol; acetic acid; for 3h; Heating;
DOI:10.1039/P19810001424

Reference yield: 85.0%

: 60297-98-5
ethyl 2-(4-carbamoylimidazol-5-ylhydrazono)acetoacetate

: 78695-87-1
methyl 8-carbamoyl-1,4-dihydro-4-methyleneimidazo<5,1-c><1,2,4>triazine-3-carboxylate

Guidance literature:: In ethanol; Heating;
DOI:10.1039/P19810001424

Reference yield:

: 105-45-3
acetoacetic acid methyl ester

: 78695-87-1
methyl 8-carbamoyl-1,4-dihydro-4-methyleneimidazo<5,1-c><1,2,4>triazine-3-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1: 1.) nitrous acid / 2.) ethanol

2: 88 percent / ethanol; acetic acid / 3 h / Heating

With cis-nitrous acid; In ethanol; acetic acid;
DOI:10.1039/P19810001424