Theophyllidine

Base Information

Chemical Name:Theophyllidine
CAS No.:6736-40-9
Molecular Formula:C6H10N4O
Molecular Weight:154.17
Hs Code.:
European Community (EC) Number:641-886-4
UNII:76560HOO1I
DSSTox Substance ID:DTXSID90217706
Wikidata:Q27266450
Mol file:6736-40-9.mol

Synonyms:Theophyllidine;6736-40-9;N-methyl-4-(methylamino)-1H-imidazole-5-carboxamide;1H-Imidazole-4-carboxamide, N-methyl-5-(methylamino)-;76560HOO1I;N-Methyl-5-methylamino-1H-imidazole-4-carboxamide;N-methyl-5-(methylamino)-1H-imidazole-4-carboxamide;N-Methyl-5-(methylamino)-1H-imidazole-4-carboxamide (Theophyllidine);Theophyllidin;UNII-76560HOO1I;Theophyllidine,crm standard;SCHEMBL3915349;DTXSID90217706;HBYDWASAZICSRC-UHFFFAOYSA-N;4-methylamino-5-methylcarbamoylimidazole;THEOPHYLLINE IMPURITY D [EP IMPURITY];DIPROPHYLLINE IMPURITY A [EP IMPURITY];A900351;Q27266450;4-(METHYLAMINO)-5-(N-METHYLCARBAMOYL)IMIDAZOLE;THEOPHYLLINE MONOHYDRATE IMPURITY D [EP IMPURITY];Diprophylline Imp. A (EP);N-Methyl-4-(methylamino)-1H-imidazol-5-carboxamid

Suppliers and Price of Theophyllidine

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

Medical Isotopes, Inc.
Theophyllidine 99%
50 mg
$ 1490.00

Total 8 raw suppliers

Chemical Property of Theophyllidine

Chemical Property:

Boiling Point:500.9±35.0 °C(Predicted)
PKA:12.27±0.10(Predicted)
PSA：73.30000
Density:1.276±0.06 g/cm3(Predicted)
LogP:0.45880
XLogP3:0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:154.08546096
Heavy Atom Count:11
Complexity:150

Purity/Quality:

97% ^*data from raw suppliers

Theophyllidine 99% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CNC1=C(NC=N1)C(=O)NC

Technology Process of Theophyllidine

There total 3 articles about Theophyllidine 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: