(S)-2-bromo-N-(1-phenylethyl)ethanamine hydrobromide

Base Information

• Chemical Name: (S)-2-bromo-N-(1-phenylethyl)ethanamine hydrobromide
• CAS No.: 100596-36-9
• Molecular Formula: C10H15Br2N
• Molecular Weight: 309.044
• DSSTox Substance ID: DTXSID80539101
• Mol file: 100596-36-9.mol

Synonyms:100596-36-9;(1S)-N-(2-bromoethyl)-1-phenylethanamine;hydrobromide;(S)-2-bromo-N-(1-phenylethyl)ethanamine hydrobromide;COXLNWYFVXMNNR-FVGYRXGTSA-N;SCHEMBL7786432;DTXSID80539101;(S)-(-)-N-(2-bromoethyl)-alpha-methylbenzylamine hydrobromide;(1S)-N-(2-Bromoethyl)-1-phenylethan-1-amine--hydrogen bromide (1/1)

Chemical Property of (S)-2-bromo-N-(1-phenylethyl)ethanamine hydrobromide

Chemical Property:

• PSA: 12.03000
• LogP: 4.08110
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 4
• Exact Mass: 308.95508
• Heavy Atom Count: 13
• Complexity: 110

Purity/Quality:

(2-BROMO-ETHYL)(1-PHENYL-ETHYL)AMINE HYDROBROMIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC=CC=C1)NCCBr.Br
• Isomeric SMILES: C[C@@H](C1=CC=CC=C1)NCCBr.Br

Technology Process of (S)-2-bromo-N-(1-phenylethyl)ethanamine hydrobromide

There total 3 articles about (S)-2-bromo-N-(1-phenylethyl)ethanamine hydrobromide 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: 82.0%

(S)-(-)-N-(2-hydroxyethyl)-α-methylbenzylamine (6623-43-4,80548-31-8,66849-29-4) → hydrobromide (-)-N-(2-bromzethyl)-α-phenylethylamine (100596-36-9)

Guidance literature:

With sulfurous dibromide; In benzene; for 3h; water bath;

DOI:10.1007/BF00475367

Reference yield: 68.4%

(S)-1-phenyl-ethylamine (2627-86-3) + 2-bromoethanol (540-51-2) → hydrobromide (-)-N-(2-bromzethyl)-α-phenylethylamine (100596-36-9)

Guidance literature:

With hydrogen bromide; In dichloromethane; ethyl acetate;

Reference yield: 64.8%

→ hydrobromide (-)-N-(2-bromzethyl)-α-phenylethylamine (100596-36-9)

Guidance literature:

upstream raw materials:

(S)-(-)-N-(2-hydroxyethyl)-α-methylbenzylamine

(S)-1-phenyl-ethylamine

2-bromoethanol