2-diethylaminoethyl (E)-3-phenylprop-2-enoate

Base Information

• Chemical Name: 2-diethylaminoethyl (E)-3-phenylprop-2-enoate
• CAS No.: 10369-88-7
• Molecular Formula: C₁₅H₂₁NO₂
• Molecular Weight: 247.337
• NSC Number: 68543
• DSSTox Substance ID: DTXSID20364353
• Nikkaji Number: J1.579.530A
• Wikidata: Q82148272
• ChEMBL ID: CHEMBL1740432
• Mol file: 10369-88-7.mol

Synonyms:2-diethylaminoethyl (E)-3-phenylprop-2-enoate;10369-88-7;2-(diethylamino)ethyl (2E)-3-phenylprop-2-enoate;NSC607418;Cinnamic acid, 2-(diethylamino)ethyl ester;SCHEMBL7908382;CHEMBL1740432;DTXSID20364353;NSC68543;NSC-68543;STK095779;AKOS003658447;2-(Diethylamino)ethyl 3-phenylacrylate hydrobromide;2-(Diethylamino)ethyl (2E)-3-phenyl-2-propenoate #;Propenoic acid, 3-phenyl-, 2-(diethylamino)ethyl ester;3-Phenylpropane-2-enoic acid 2-(diethylamino)ethyl ester

Chemical Property of 2-diethylaminoethyl (E)-3-phenylprop-2-enoate

Chemical Property:

• Vapor Pressure: 2.66E-05mmHg at 25°C
• Boiling Point: 357.8°Cat760mmHg
• Flash Point: 123.6°C
• Density: 1.029g/cm³
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 247.157228913
• Heavy Atom Count: 18
• Complexity: 253

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CCOC(=O)C=CC1=CC=CC=C1
• Isomeric SMILES: CCN(CC)CCOC(=O)/C=C/C1=CC=CC=C1

Technology Process of 2-diethylaminoethyl (E)-3-phenylprop-2-enoate

There total 1 articles about 2-diethylaminoethyl (E)-3-phenylprop-2-enoate 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:

cinnamoyl chloride (102-92-1,17082-09-6) + 2-(Diethylamino)ethanol (100-37-8) → 3-phenyl-acrylic acid 2-diethylamino-ethyl ester (10369-88-7)

Guidance literature:

Reference yield:

3-phenyl-acrylic acid 2-diethylamino-ethyl ester (10369-88-7) → 3-benzylidene-4,4-diethyl-2-oxo-morpholinium; bromide (54971-52-7)

Guidance literature:

With bromine; In tetrachloromethane; at -10 ℃;

Reference yield:

3-phenyl-acrylic acid 2-diethylamino-ethyl ester (10369-88-7) → 3-bromo-3-(bromo-phenyl-methyl)-4,4-diethyl-2-oxo-morpholinium; bromide (54971-56-1)

Guidance literature:

Multi-step reaction with 2 steps

1: Br₂ / CCl₄ / -10 °C

2: Br₂ / CHCl₃

With bromine; In tetrachloromethane; chloroform;

upstream raw materials:

cinnamoyl chloride

2-(Diethylamino)ethanol

Downstream raw materials:

2,3-Dibromo-3-phenyl-propionic acid 2-diethylamino-ethyl ester

3-benzylidene-4,4-diethyl-2-oxo-morpholinium; bromide

3-bromo-3-(bromo-phenyl-methyl)-4,4-diethyl-2-oxo-morpholinium; bromide