(2R)-1-amino-3-phenoxypropan-2-ol

Base Information

• Chemical Name: (2R)-1-amino-3-phenoxypropan-2-ol
• CAS No.: 133522-40-4
• Molecular Formula: C9H13 N O2
• Molecular Weight: 167.208
• DSSTox Substance ID: DTXSID901299441
• Mol file: 133522-40-4.mol

Synonyms:133522-40-4;(2R)-1-amino-3-phenoxypropan-2-ol;(2R)-(+)-1-AMINO-3-PHENOXY-2-PROPANOL;2-Propanol,1-amino-3-phenoxy-, (2R)-;(R)-1-Amino-3-phenoxypropan-2-ol;(2r)-1-amino-3-phenoxy-2-propanol;(R)-1-Amino-3-phenoxy-2-propanol;SCHEMBL5878404;DTXSID901299441;MFCD00673145;AKOS006273965

Chemical Property of (2R)-1-amino-3-phenoxypropan-2-ol

Chemical Property:

• Melting Point: 98 - 100 °C (methanol)
• Boiling Point: 330.2±27.0 °C(Predicted)
• PKA: 12.04±0.35(Predicted)
• PSA: 55.48000
• Density: 1.129±0.06 g/cm3(Predicted)
• LogP: 1.08530
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 167.094628657
• Heavy Atom Count: 12
• Complexity: 113

Purity/Quality:

99% ^*data from raw suppliers

(2R)-(+)-1-AMINO-3-PHENOXY-2-PROPANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OCC(CN)O
• Isomeric SMILES: C1=CC=C(C=C1)OC[C@@H](CN)O

Technology Process of (2R)-1-amino-3-phenoxypropan-2-ol

There total 10 articles about (2R)-1-amino-3-phenoxypropan-2-ol 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: 53.0%

(2R)-1,2-epoxy-3-phenoxypropane (71031-03-3,71031-02-2) → (R)-(-)-1-amino-3-phenyloxy-2-propanol (133522-40-4)

Guidance literature:

With ammonium hydroxide; at 20 ℃; for 18h;

DOI:10.1016/j.bmc.2012.08.007

Reference yield:

(2R)-1-azido-3-phenoxypropan-2-ol (140630-37-1) → (R)-(-)-1-amino-3-phenyloxy-2-propanol (133522-40-4)

Guidance literature:

With hydrogen; palladium on activated charcoal; In methanol;

DOI:10.1016/S0957-4166(00)80191-3

Reference yield:

(2R,3R,3aS,6R,6aR,3'R,3'aS,6'R,6'aR,5''R)-spiro[6,3',6'-trihydroxy-octahydro[2,3']bi[furo[3,2-b]furan]-3,2''-[5''-phenoxymethyl-1'',3''-oxazolidine]] (929548-38-9) → (R)-(-)-1-amino-3-phenyloxy-2-propanol (133522-40-4)

Guidance literature:

With hydrogenchloride; In methanol; at 20 ℃; for 0.5h;

DOI:10.1016/j.tetasy.2008.01.039

upstream raw materials:

(2R)-1,2-epoxy-3-phenoxypropane

(2R)-1-azido-3-phenoxypropan-2-ol

Phenyl glycidyl ether

(RS)-1-chloro-3-phenyloxy-2-propanol

Downstream raw materials:

C₂₈H₂₃ClN₆O₃S