[Methoxy(phenyl)methylidene]azanium;chloride

Base Information

• Chemical Name: [Methoxy(phenyl)methylidene]azanium;chloride
• CAS No.: 5873-90-5
• Molecular Formula: C8H9 N O . Cl H
• Molecular Weight: 171.626
• Hs Code.: 29299000
• Mol file: 5873-90-5.mol

Synonyms:

Chemical Property of [Methoxy(phenyl)methylidene]azanium;chloride

Chemical Property:

• Vapor Pressure: 1.89mmHg at 25°C
• Melting Point: 105-107 °C (dec.)(lit.)
• Boiling Point: 171.1°Cat760mmHg
• Flash Point: 57.3°C
• Density: g/cm³
• Storage Temp.: Refrigerator
• Water Solubility.: almost transparency
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 171.0450916
• Heavy Atom Count: 11
• Complexity: 116

Purity/Quality:

98%,99%, ^*data from raw suppliers

Methyl benzimidate hydrochloride ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC(=[NH2+])C1=CC=CC=C1.[Cl-]
• Uses: Methyl benzimidate hydrochloride was used:in the synthesis of chiral phenyldihydroimidazole derivativeas imidating reagent to modify Lys residues of cyclic Lys-Gly-Asp peptide to afford acetimidate analogsin the synthesis of N-benzimidoyl-(1,2-dipalmitoyl-sn-glycero-3-phosphoethanolamine)

Technology Process of [Methoxy(phenyl)methylidene]azanium;chloride

There total 7 articles about [Methoxy(phenyl)methylidene]azanium;chloride 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: 92.1%

methanol (67-56-1) + benzonitrile (100-47-0) → methyl benzimidate hydrochloride (5873-90-5)

Guidance literature:

With hydrogenchloride; at 5 - 10 ℃; for 10h; Solvent; Concentration;

DOI:10.1039/c3gc40774h

Reference yield: 62.0%

methanol (67-56-1) + phenylacetylene (536-74-3) → methyl benzimidate hydrochloride (5873-90-5)

Guidance literature:

With hydrogenchloride; In hexane; at 0 ℃; for 3h;

DOI:10.1055/s-2001-18080

Reference yield: 51.6%

piperidine (110-89-4) + 1-[1-Methoxy-1-phenyl-meth-(Z)-ylidene]-3-p-tolyl-urea (124255-72-7) → N-4-Methylphenyl-N',N'-pentamethylenharnstoff (2589-19-7) + methyl benzimidate hydrochloride (5873-90-5)

Guidance literature:

upstream raw materials:

methanol

benzonitrile

piperidine

1-[1-Methoxy-1-phenyl-meth-(Z)-ylidene]-3-p-tolyl-urea

Downstream raw materials:

2,3-diphenyl-4,5-dihydro-3H-[1,3]azarsole

4,4,5,5-tetramethyl-2-phenyl-4,5-dihydro-1H-imidazole

3-Benzyl-2-phenyl-4,5-dihydro-3H-[1,3]azaphosphole

2-phenyl-4-(2'-chlorobenzylidene)-2-imidazolin-5-one

Refernces

• 1、 Golubev, Pavel R.,Pankova, Alena S.,Kuznetsov, Mikhail A.. "Transition-metal-free approach to 4-ethynylpyrimidines via alkenynones". . p. 3614 - 3621. Retrieved 2014/06/23.
• 2、 Balo, Carmen,Lopez, Carmen,Brea, Jose Manuel,Fernandez, Franco,Caamano, Olga. "Synthesis and evaluation of adenosine antagonist activity of a series of [1,2,4]triazolo[1,5-c]quinazolines". . p. 372 - 375. Retrieved 2008/02/02.