(R)-Cyclopropyl(2-fluorophenyl)methanamine hydrochloride

Base Information

• Chemical Name: (R)-Cyclopropyl(2-fluorophenyl)methanamine hydrochloride
• CAS No.: 1213846-75-3
• Molecular Formula: C10H13ClFN
• Molecular Weight: 201.6683232
• Hs Code.: 2921499090
• DSSTox Substance ID: DTXSID10704204
• Mol file: 1213846-75-3.mol

Synonyms:(R)-Cyclopropyl(2-fluorophenyl)methanamine hydrochloride;1213846-75-3;(R)-cyclopropyl-(2-fluorophenyl)methanamine;hydrochloride;(R)-Cyclopropyl(2-fluorophenyl)methanamine HCl;(1r)-cyclopropyl(2-fluorophenyl)methylamine hydrochloride;DTXSID10704204;MFCD22371842;AKOS015923128;AS-55155;CS-0162149;Y10275;(1r)-cyclopropyl(2-fluorophenyl)methylamine HCl;A891794;(R)-Cyclopropyl(2-fluorophenyl)methanaminehydrochloride;(R)-1-Cyclopropyl-1-(2-fluorophenyl)methanamine--hydrogen chloride (1/1)

Chemical Property of (R)-Cyclopropyl(2-fluorophenyl)methanamine hydrochloride

Chemical Property:

• Boiling Point: 231.3±15.0 °C(Predicted)
• PKA: 8.87±0.10(Predicted)
• PSA: 26.02000
• Density: 1.178±0.06 g/cm3(Predicted)
• LogP: 3.73780
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 201.0720553
• Heavy Atom Count: 13
• Complexity: 156

Purity/Quality:

98% ^*data from raw suppliers

(R)-Cyclopropyl(2-fluorophenyl)methanaminehydrochloride 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CC1C(C2=CC=CC=C2F)N.Cl
• Isomeric SMILES: C1CC1[C@H](C2=CC=CC=C2F)N.Cl

Technology Process of (R)-Cyclopropyl(2-fluorophenyl)methanamine hydrochloride

There total 1 articles about (R)-Cyclopropyl(2-fluorophenyl)methanamine hydrochloride 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:

C18H30FNOSi → (S)-cyclopropyl(2-fluorophenyl)methanamine (844817-69-2,1213846-75-3)

Guidance literature:

With water; periodic acid; In methanol;

DOI:10.1016/j.bmcl.2008.12.005

Reference yield:

C9H6N4O2 + C10H12FN (1213846-75-3) → C19H16FN5O

Guidance literature:

With (benzotriazo-1-yloxy)tris(dimethylamino)phosphonium hexafluorophosphate; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide; at 20 ℃;

DOI:10.1016/j.bmcl.2013.09.055

Reference yield:

(S)-cyclopropyl(2-fluorophenyl)methanamine (844817-69-2,1213846-75-3) + 3-iodo-1H-indazole-5-carboxylic acid (885521-46-0) → 3-(4-(3-oxa-8-azabicyclo[3.2.1]octan-8-yl)phenyl)-N-((S)-cyclopropyl(2-fluorophenyl)methyl)-1H-indazole-5-carboxamide

Guidance literature:

Multi-step reaction with 2 steps

1: N-ethyl-N,N-diisopropylamine; bis-(2-oxo-3-oxazolidinyl)phosphoryl chloride / N,N-dimethyl-formamide / 0 - 20 °C

2: sodium carbonate / water / Inert atmosphere; Reflux

With bis-(2-oxo-3-oxazolidinyl)phosphoryl chloride; sodium carbonate; N-ethyl-N,N-diisopropylamine; In water; N,N-dimethyl-formamide; 2: |Suzuki-Miyaura Coupling;

DOI:10.1021/jm501740a

Refernces