(R)-(+)-2-(alpha-Methylbenzylamino)-5-nitropyridine

Base Information

• Chemical Name: (R)-(+)-2-(alpha-Methylbenzylamino)-5-nitropyridine
• CAS No.: 64138-65-4
• Molecular Formula: C₁₃H₁₃N₃O₂
• Molecular Weight: 243.265
• European Community (EC) Number: 678-609-1
• DSSTox Substance ID: DTXSID10463783
• Nikkaji Number: J208.738C
• Wikidata: Q76416999
• Mol file: 64138-65-4.mol

Synonyms:64138-65-4;(R)-(+)-2-(alpha-Methylbenzylamino)-5-nitropyridine;(R)-5-Nitro-N-(1-phenylethyl)pyridin-2-amine;5-NITRO-N-[(1R)-1-PHENYLETHYL]PYRIDIN-2-AMINE;MFCD00060067;M0909;SCHEMBL2792928;DTXSID10463783;RAKMWGKBCDCUDX-SNVBAGLBSA-N;AKOS015840184;CS-W010267;AS-66134;inverted exclamation mark(2)R inverted exclamation mark(3)-(+)-2-(Alpha-Methylbenzylamino)-5-nitropyridine;W17516;A867944;N-(5-Nitro-2-pyridinyl)-N-(1-phenylethyl)amine #;R-(+)-2-(.alpha.-Methylbenzylamino)-5-nitropyridine;r-(+)-5-nitro-2-[N-(1-phenylethyl)-amino] pyridine

Chemical Property of (R)-(+)-2-(alpha-Methylbenzylamino)-5-nitropyridine

Chemical Property:

• Melting Point: 83°C
• Refractive Index: 146.5 ° (C=2, CHCl3)
• Boiling Point: 395.9oC at 760 mmHg
• PKA: 2.74±0.10(Predicted)
• Flash Point: 193.2oC
• PSA: 70.74000
• Density: 1.267g/cm3
• LogP: 3.75910
• Storage Temp.: Keep in dark place,Inert atmosphere,Room temperature
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 243.100776666
• Heavy Atom Count: 18
• Complexity: 274

Purity/Quality:

97% ^*data from raw suppliers

5-Nitro-N-[(1R)-1-phenylethyl]pyridin-2-amine ^*data from reagent suppliers

Safty Information:

• Statements: 20/21/22-36/37/38
• Safety Statements: 23-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C1=CC=CC=C1)NC2=NC=C(C=C2)[N+](=O)[O-]
• Isomeric SMILES: C[C@H](C1=CC=CC=C1)NC2=NC=C(C=C2)[N+](=O)[O-]

Technology Process of (R)-(+)-2-(alpha-Methylbenzylamino)-5-nitropyridine

There total 2 articles about (R)-(+)-2-(alpha-Methylbenzylamino)-5-nitropyridine 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:

(R)-1-phenyl-ethyl-amine (3886-69-9) + potassium 5-nitropyridine-2-sulfonate → 2-(α-methylbenzylamino)-5-nitropyridine (64138-65-4,84249-39-8)

Guidance literature:

In water; at 23 ℃; for 20h;

DOI:10.1039/b305620a

Reference yield:

→ 2-(α-methylbenzylamino)-5-nitropyridine (64138-65-4,84249-39-8)

Guidance literature:

entspr. Amin, 2-Chloro-5-nitropyridin;

upstream raw materials:

(R)-1-phenyl-ethyl-amine

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