51688-22-3

Basic information

• Product Name: N-CYANOMETHANIMIDIC METHYL ESTER
• Synonyms: N-CYANOMETHANIMIDIC METHYL ESTER;MethaniMidic acid, N-cyano-, Methyl ester;MethaniMidic acid;Methyl N-cyanoformimidate
• CAS NO: 51688-22-3
• Molecular Formula: C₃H₄N₂O
• Molecular Weight: 84.08
• Mol File: 51688-22-3.mol
• Article Data: 3

Chemical Properties

• Boiling Point: 89.4°C at 760 mmHg
• Flash Point: 7.9°C
• Appearance: /
• Density: 0.96g/cm³
• Vapor Pressure: 58.8mmHg at 25°C
• Refractive Index: 1.429
• PKA: -3.66±0.50(Predicted)
• CAS DataBase Reference: N-CYANOMETHANIMIDIC METHYL ESTER(CAS DataBase Reference)
• NIST Chemistry Reference: N-CYANOMETHANIMIDIC METHYL ESTER(51688-22-3)
• EPA Substance Registry System: N-CYANOMETHANIMIDIC METHYL ESTER(51688-22-3)

Safety Data

• Hazardous Substances Data: 51688-22-3(Hazardous Substances Data)

Usage

InChI:InChI=1/C3H4N2O/c1-6-3-5-2-4/h3H,1H3

Upstream product

• 420-04-2 CYANAMID 
• 149-73-5 trimethyl orthoformate 

Downstream Products

• 96412-44-1 8-amino-3-benzyl-9,10-dihydro-10-oxo-3H-1,3,5-triazino<1,2-a>purine 
• 98858-80-1 4-amino-8-methyl-1,2,3-triazolo<1,5-a>-1,3,5-triazine 
• 1439992-93-4 (E)-1-[2-cyano-2-(pyridin-2-ylsulfonyl)vinyl]urea 
• 196085-96-8 8-((3aR,6S,6aS)-2,2-Dimethyl-6-trityloxymethyl-tetrahydro-furo[3,4-d][1,3]dioxol-4-yl)-pyrazolo[1,5-a][1,3,5]triazin-4-ylamine 
• 96575-89-2 4-amino-8-(benzylmethylamino)-6-oxo-6H-pyrimido<1,2-a>-1,3,5-triazine 
• 96412-46-3 8-amino-3-benzyl-2-bromo-9,10-dihydro-10-oxo-3H-1,3,5-triazino<1,2-a>purine 

Relevant articles and documents

Imidazo-oxazinone compound as well as preparation method and application thereof

The invention provides an imidazo-oxazinone compound as well as a preparation method and application thereof. The imidazo-oxazinone compound has a structure shown in a formula (I). A series of imidazo-oxazinone compounds are synthesized by using a microwa

Chemical Modification of Nucleic Acid Components: Reactions of Cytosine, Cytidine, Isocytosine, and Adenine with Methyl N-Cyanomethanimidate

Reaction products of cytosine, cytidine, isocytosine, and adenine with methyl N-cyanomethanimidate (1) are reported.Thus, the reactions of cytidine and cytosine with 1 yielded (6,7-dihydro-6-oxo-7-β-D-ribofuranosyl-4H-pyrimido-1,3,5-triazin-4-ylidene)guanidine (4) and (6,7-dihydro-6-oxo-4H-pyrimido-1,3,5-triazin-4-ylidene)guanidine (5), respectively.The interrelationship between the two compounds was established by deribosidation of 4.The reaction of 1 with isocytosine gave two isomeric products: (6-oxo-6H-pyrimido-1,3,5-triazin-4-yl)guanidine (9) and (8-oxo-8H-pyrimido-1,3,5-triazin-4-yl)guanidine (10).The two products were differentiated by several means, including dehydrative cyclization of 9.Adenine and 1 also gave three products: N6-adenine (21) and two fluorescent isomers, (7H-1,3,5-triazinopurin-7-ylidene)guanidine (20) and (9H-1,3,5-triazinopurin-9-ylidene)guanidine (22).The structures of the products were established by 1H and 13C NMR, IR, UV, and mass spectral analyses and, where necessary, by unequivocal syntheses.The source of the incorporation of a cyanamide unit into the structures of the final products (e.g., 4, 5, 9, 10, 20, and 22) was explored by studying the behavior of the reagent 1 toward nucleophiles, e.g., H2O (D2O), and by isolation of the major byproducts of the reactions.The fluorescence spectral data for the final compounds are also reported.The compounds from isocytosine, 9 and 10, and one from adenine, 22, exhibit exceptionally large Stokes shifts.