2-Ethylbenzaldehyde

Base Information

• Chemical Name: 2-Ethylbenzaldehyde
• CAS No.: 22927-13-5
• Molecular Formula: C9H10O
• Molecular Weight: 134.178
• Hs Code.: 2912299000
• DSSTox Substance ID: DTXSID70177470
• Nikkaji Number: J535.825F
• Wikidata: Q72472762
• Mol file: 22927-13-5.mol

Synonyms:2-Ethylbenzaldehyde;22927-13-5;Benzaldehyde, 2-ethyl-;2-Ethyl benzaldehyde;MFCD02261766;o-Ethylbenzaldehyde;2-Ethyl-benzaldehyd;2-EthYl-Benzaldehyde;ETHYLBENZALDEHYDE;SCHEMBL224815;DTXSID70177470;BCP06174;AKOS015890190;CS-W007787;GS-3888;SY066602;FT-0659699;EN300-62686;A24266;S-3422;J-014906;Z979776466

Chemical Property of 2-Ethylbenzaldehyde

Chemical Property:

• Vapor Pressure: 0.2mmHg at 25°C
• Melting Point: 210 °C
• Refractive Index: n20/D 1.538(lit.)
• Boiling Point: 209.666 °C at 760 mmHg
• Flash Point: 84.775 °C
• PSA: 17.07000
• Density: 1.002 g/cm³
• LogP: 2.06150
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 134.073164938
• Heavy Atom Count: 10
• Complexity: 109

Purity/Quality:

99% ^*data from raw suppliers

2-Ethylbenzaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCC1=CC=CC=C1C=O
• Uses: A volatile derivative of benzaldehyde present in animal-derived food products. Reactant for:Preparation of potential antibacterial agentsAsymmetric addition reactionsSolid-phase synthesis of BODIPY dyes and development of an Ig fluorescent sensorCondensation reactions with phenylenediamine or aminothiophenol catalyzed by Mesoporous mixed metal oxide nanocrystals preparaed from aero gel process

Technology Process of 2-Ethylbenzaldehyde

There total 36 articles about 2-Ethylbenzaldehyde 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: 99.0%

1-bromo-2-ethylbenzene (1973-22-4) + N,N-dimethyl-formamide (68-12-2,33513-42-7) → 2-ethylbenzaldehyde (22927-13-5)

Guidance literature:

1-bromo-2-ethylbenzene; In dichloromethane; cyclohexane; at -78 - -75 ℃; for 1.5h;

N,N-dimethyl-formamide; In dichloromethane; cyclohexane; for 1h; Solvent;

Reference yield: 93.0%

2-ethynylbenzaldehyde (38846-64-9) → 2-ethylbenzaldehyde (22927-13-5)

Guidance literature:

With hydrogen; In methanol; at 20 ℃; for 2h; chemoselective reaction;

DOI:10.1016/j.tet.2012.07.044

Reference yield: 91.0%

2-Ethylbenzaldehyde Cyclohexylimine → 2-ethylbenzaldehyde (22927-13-5)

Guidance literature:

With hydrogenchloride; In diethyl ether; for 12h; Ambient temperature;

DOI:10.1021/jo00061a020

upstream raw materials:

2-vinylbenzaldehyde

(2-ethylphenyl)methanol

2-ethylbenzoyl chloride

formaldoxime

Downstream raw materials:

3-phenylpropionamide

2-bromo-1-phenyl-1-propanone

(2-Ethyl-phenyl)-(3-methyl-isothiazol-5-yl)-methanol

(Z)-2-ethyl-4'-methylstilbene

Refernces

• 1、 Slot, Thierry K.,Eisenberg, David,van Noordenne, Dylan,Jungbacker, Peter,Rothenberg, Gadi. "Cooperative Catalysis for Selective Alcohol Oxidation with Molecular Oxygen". . p. 12307 - 12311. Retrieved 2016.
• 2、 -. "6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE INDOLE-2-CARBOXAMIDES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV)". Page/Page column 52-53. . Retrieved 2020/05/29.
• 3、 -. "NOVEL OXALYL PIPERAZINES ACTIVE AGAINST THE HEPATITIS B VIRUS (HBV)". Page/Page column 69; 70. . Retrieved 2020/11/12.