5-(Chloromethyl)-2-phenyl-1,3-oxazolidine

Base Information

• Chemical Name: 5-(Chloromethyl)-2-phenyl-1,3-oxazolidine
• CAS No.: 69157-36-4
• Molecular Formula: C10H12 Cl N O
• Molecular Weight: 197.66138
• Hs Code.: 2934999090
• European Community (EC) Number: 684-792-9
• NSC Number: 113414
• DSSTox Substance ID: DTXSID50297044
• Mol file: 69157-36-4.mol

Synonyms:5-(chloromethyl)-2-phenyl-1,3-oxazolidine;69157-36-4;5-(Chloromethyl)-2-phenyloxazolidine;NSC113414;SCHEMBL10759556;DTXSID50297044;MYTJGIQZYJQZNI-UHFFFAOYSA-N;2-Phenyl-5-chlormethyl-oxazolidin;2-phenyl-5-chloromethyloxazolidine;STL301627;5-(chloromethyl)-2-phenyl-oxazolidine;AKOS022133050;NSC-113414

Chemical Property of 5-(Chloromethyl)-2-phenyl-1,3-oxazolidine

Chemical Property:

• Vapor Pressure: 0.000415mmHg at 25°C
• Boiling Point: 316.3°C at 760 mmHg
• Flash Point: 145.1°C
• PSA: 21.26000
• Density: 1.146g/cm³
• LogP: 2.24120
• Storage Temp.: Refrigerator
• Solubility.: DMSO (Slightly), Methanol (Slightly)
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 197.0607417
• Heavy Atom Count: 13
• Complexity: 159

Purity/Quality:

99%min ^*data from raw suppliers

5-(Chloromethyl)-2-phenyloxazolidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(OC(N1)C2=CC=CC=C2)CCl
• Uses: 5-(Chloromethyl)-2-phenyloxazolidine is used in the synthesis of mixed glycerides.

Technology Process of 5-(Chloromethyl)-2-phenyl-1,3-oxazolidine

There total 3 articles about 5-(Chloromethyl)-2-phenyl-1,3-oxazolidine 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:

benzaldehyde (100-52-7) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → 5-chloromethyl-2-phenyl-oxazolidine (69157-36-4)

Guidance literature:

With ethanol; ammonia;

DOI:10.1021/jo01353a606 DOI:10.1021/ja01106a506

Reference yield:

3-(3-chloro-2-hydroxy-propylamino)-crotonic acid ethyl ester → 5-chloromethyl-2-phenyl-oxazolidine (69157-36-4)

Guidance literature:

With hydrogenchloride; Behandeln der durch Ausaethern vom Acetessigester befreiten Loesung mit Benzaldehyd und Kaliumcarbonat;

Reference yield:

benzaldehyde (100-52-7) → 5-chloromethyl-2-phenyl-oxazolidine (69157-36-4)

Guidance literature:

With potassium carbonate;

upstream raw materials:

benzaldehyde

epichlorohydrin

Downstream raw materials:

N-(3-chloro-2-hydroxy-propyl)-benzamide

N-Cyclohexylcarbonyl-2-hydroxy-3-chlor-1-aminopropan

N-(2-fluorobenzoyl)-3-chloro-1-aminopropan-2-ol

N-[3-(4-Chloro-phenylamino)-2-hydroxy-propyl]-acetamide