Aniline, N-(2-oxazolin-2-YL)-

Base Information

• Chemical Name: Aniline, N-(2-oxazolin-2-YL)-
• CAS No.: 27151-01-5
• Molecular Formula: C9H10 N2 O
• Molecular Weight: 162.191
• Hs Code.: 2934999090
• NSC Number: 160004
• UNII: TYG70FN2WE
• DSSTox Substance ID: DTXSID30181619
• Nikkaji Number: J914.302E
• Wikidata: Q83052242
• ChEMBL ID: CHEMBL498826
• Mol file: 27151-01-5.mol

Synonyms:ANILINE, N-(2-OXAZOLIN-2-YL)-;27151-01-5;2-Anilino-2-oxazoline;N-(2-Oxazolinyl)aniline;2-Phenyliminooxazolidine;TYG70FN2WE;Oxazole, 4,5-dihydro-2-phenylamino-;NSC 160004;NSC-160004;2-(phenylimino)oxazolidine;oxazolinylaniline;NSC160004;N-phenyl-4,5-dihydro-1,3-oxazol-2-amine;UNII-TYG70FN2WE;CHEMBL498826;SCHEMBL1852745;SCHEMBL17728316;DTXSID30181619;2-OXAZOLINE, 2-ANILINO-;2-N-PHENYLAMINO-2-OXAZOLINE;AKOS006278433;OXAZOLIDINE, 2-(PHENYLIMINO)-;2-Oxazolamine, 4,5-dihydro-N-phenyl-;2-(PHENYLIMINO)-1,3-OXAZOLIDINE;LS-19933;4,5-DIHYDRO-N-PHENYL-2-OXAZOLAMINE

Chemical Property of Aniline, N-(2-oxazolin-2-YL)-

Chemical Property:

• Vapor Pressure: 0.0231mmHg at 25°C
• Boiling Point: 249.3°Cat760mmHg
• Flash Point: 104.6°C
• PSA: 33.62000
• Density: 1.19g/cm³
• LogP: 0.99330
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 162.079312947
• Heavy Atom Count: 12
• Complexity: 173

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COC(=N1)NC2=CC=CC=C2

Technology Process of Aniline, N-(2-oxazolin-2-YL)-

There total 16 articles about Aniline, N-(2-oxazolin-2-YL)- 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: 98.0%

1-(2-chloroethyl)-3-phenylurea (7144-13-0) → 4,5-dihydro-N-phenyl-2-oxazolamine (27151-01-5)

Guidance literature:

With SiO₂*KF; In acetonitrile; Heating;

DOI:10.1016/j.bmc.2008.06.028

Reference yield: 84.0%

N-2-hydroxyethyl-N'-phenylthiourea (102-12-5) → 4,5-dihydro-N-phenyl-2-oxazolamine (27151-01-5)

Guidance literature:

With KO₂; In acetonitrile; at 20 ℃; for 10h;

DOI:10.1055/s-1997-1030

Reference yield: 76.5%

1-(2-hydroxyethyl)-3-phenylurea (3747-47-5) → 4,5-dihydro-N-phenyl-2-oxazolamine (27151-01-5)

Guidance literature:

With tetrachloromethane; triethylamine; triphenylphosphine; In pyridine; acetonitrile; at 2 ℃; for 20h;

DOI:10.1016/0040-4020(93)80021-K

upstream raw materials:

ethanol

1-(2-chloroethyl)-3-phenylurea

1-(2-hydroxyethyl)-3-phenylurea

N-(2-bromoethyl)-N'-phenylurea

Downstream raw materials:

N-phthaloylglycine-2-phenyliminooxazolidine

N-benzoyl-2 phenyliminooxazolidine

N-(2-chloroethyl) O-ethyl S-(1-methylpropyl) N-phenylaminocarbonyl phosphoramidothioate

N-p-nitrobenzoyl-2-phenyliminooxazolidine