N-[(3-nitrophenyl)methyl]prop-2-en-1-amine

Base Information

• Chemical Name: N-[(3-nitrophenyl)methyl]prop-2-en-1-amine
• CAS No.: 893590-94-8
• Molecular Formula: C₁₀H₁₂N₂O₂
• Molecular Weight: 192.217
• European Community (EC) Number: 967-255-6

Synonyms:893590-94-8;[(3-NITROPHENYL)METHYL](PROP-2-EN-1-YL)AMINE;N-[(3-nitrophenyl)methyl]prop-2-en-1-amine;AKOS000247553;EN300-144979

Chemical Property of N-[(3-nitrophenyl)methyl]prop-2-en-1-amine

Chemical Property:

• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 4
• Exact Mass: 192.089877630
• Heavy Atom Count: 14
• Complexity: 201

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C=CCNCC1=CC(=CC=C1)[N+](=O)[O-]

Technology Process of N-[(3-nitrophenyl)methyl]prop-2-en-1-amine

There total 2 articles about N-[(3-nitrophenyl)methyl]prop-2-en-1-amine 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: 88.0%

3-nitro-benzaldehyde (99-61-6) + 1-amino-2-propene (107-11-9,30551-89-4) → N-(3-nitrobenzyl)prop-2-en-1-amine (893590-94-8)

Guidance literature:

With sodium tris(acetoxy)borohydride; In dichloromethane; at 20 ℃;

DOI:10.1021/jm201112g

Reference yield:

C10H10N2O2 → N-(3-nitrobenzyl)prop-2-en-1-amine (893590-94-8)

Guidance literature:

With sodium tetrahydroborate; In methanol; at 0 ℃; for 1h;

DOI:10.1248/cpb.56.1147

Reference yield: 99.0%

N-(3-nitrobenzyl)prop-2-en-1-amine (893590-94-8) + trifluoroacetic anhydride (407-25-0) → N-allyl-2,2,2-trifluoro-N-(3-nitrobenzyl)acetamide (1354566-84-9)

Guidance literature:

With triethylamine; In tetrahydrofuran; at 20 ℃; for 1h;

DOI:10.1021/jm201112g

upstream raw materials:

3-nitro-benzaldehyde

1-amino-2-propene

Downstream raw materials:

C₁₇H₁₈N₂O₅S

N-allyl-N-(3-aminobenzyl)-2,2,2-trifluoroacetamide

N-allyl-N-{3-[4-(3-but-3-enyloxyphenyl)pyrimidin-2-ylamino]benzyl}-2,2,2-trifluoroacetamide

N-allyl-2,2,2-trifluoro-N-(3-nitrobenzyl)acetamide

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