Diethyl cyclohexylaminovinylphosphate

Base Information

• Chemical Name: Diethyl cyclohexylaminovinylphosphate
• CAS No.: 20061-84-1
• Molecular Formula: C18H14N2
• Molecular Weight: 261.301
• Hs Code.: 2931900090
• European Community (EC) Number: 243-492-4
• NSC Number: 165750
• Nikkaji Number: J82.924B
• Wikidata: Q76305312
• Mol file: 20061-84-1.mol

Synonyms:20061-84-1;Diethyl cyclohexylaminovinylphosphate;N-[(E)-2-diethoxyphosphorylethenyl]cyclohexanamine;Diethyl-2-(cyclohexylamino)-vinylphosphonate;Phosphonic acid, [2-(cyclohexylamino)ethenyl]-, diethyl ester;Phosphonic acid, P-[2-(cyclohexylamino)ethenyl]-, diethyl ester;Diethyl 2-(cyclohexylamino)vinylphosphonate;C12H24NO3P;C12-H24-N-O3-P;Diethyl (E)-2-(cyclohexylamino)ethenylphosphonate;SCHEMBL9153544;GCOCYGLSBKOTBU-ZHACJKMWSA-N;NSC165750;AKOS015907112;NSC-165750;(E)-diethyl 2-(cyclohexylamino)vinylphosphonate;Diethyl(E)-2-(cyclohexylamino)ethenylphosphonate;A814211;A814608;cyclohexyl-[(E)-2-diethoxyphosphoryl-vinyl]-amine;Diethyl (E)-2-(cyclohexylamino)ethenylphosphonate #;2-(Cyclohexylamino)vinylphosphonic acid diethyl ester;(2-Cyclohexylamino-vinyl)-phosphonic acid, diethyl ester

Chemical Property of Diethyl cyclohexylaminovinylphosphate

Chemical Property:

• Vapor Pressure: 2.82E-05mmHg at 25°C
• Refractive Index: 1.47
• Boiling Point: 356.944 °C at 760 mmHg
• Flash Point: 169.674 °C
• PSA: 57.37000
• Density: 1.053 g/cm³
• LogP: 4.03690
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 261.14938063
• Heavy Atom Count: 17
• Complexity: 265

Purity/Quality:

98%min ^*data from raw suppliers

DIETHYL CYCLOHEXYLAMINOVINYLPHOSPHATE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOP(=O)(C=CNC1CCCCC1)OCC
• Isomeric SMILES: CCOP(=O)(/C=C/NC1CCCCC1)OCC

Technology Process of Diethyl cyclohexylaminovinylphosphate

There total 4 articles about Diethyl cyclohexylaminovinylphosphate 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: 70.0%

(2-oxoethyl)phosphonic acid diethyl ester (1606-75-3) + cyclohexylamine (108-91-8,157973-60-9) → diethyl 2-(cyclohexylimino)ethylphosphonate (20061-84-1)

Guidance literature:

In acetonitrile; for 15h; Ambient temperature;

DOI:10.1021/jo00134a017

Reference yield:

diethyl phosphonoacetaldehyde diethyl acetal (7598-61-0) → diethyl 2-(cyclohexylimino)ethylphosphonate (20061-84-1)

Guidance literature:

Multi-step reaction with 2 steps

1: 33.91 g / 2percent aq. HCl / Heating

2: 48.52 percent / methanol / 0.17 h / 20 °C

With 2percent aq. HCl; In methanol;

DOI:10.1021/jm011101q

Reference yield:

→ diethyl 2-(cyclohexylimino)ethylphosphonate (20061-84-1)

Guidance literature:

DOI:10.1016/S0040-4039(01)99131-2 DOI:10.1039/j39690000460

upstream raw materials:

(2-oxoethyl)phosphonic acid diethyl ester

cyclohexylamine

diethyl phosphonoacetaldehyde diethyl acetal

Downstream raw materials:

(E/Z)-3,7-dimethyl-2,6-octadienal

3,3-bis(4-chlorophenyl)acrylaldehyde

cyclohexylideneacetaldehyde

seq.trans-3-Formylmethylen-17β-benzoyloxy-5α-androstan

Refernces

• 1、 Farnum, D. G.,Ghandi, M.,Raghu, S.,Reitz, T.. "A New Entry to the C12H12 Energy Surface: Pyrolysis and Photolysis of trans-β-nona-2,4,6-trienyl>acrolein Tosylhydrazone Saltz". . p. 2598 - 2607. Retrieved 2007/10/02.