4-(Allyloxy)aniline hydrochloride

Base Information

• Chemical Name: 4-(Allyloxy)aniline hydrochloride
• CAS No.: 88271-75-4
• Molecular Formula: C9H11NO.ClH
• Molecular Weight: 185.653
• DSSTox Substance ID: DTXSID00589249

Synonyms:88271-75-4;4-(allyloxy)aniline hydrochloride;4-Prop-2-enoxyaniline;hydrochloride;Benzenamine, 4-(2-propenyloxy)-, hydrochloride;p-allyloxyaniline hydrochloride;SCHEMBL9430026;DTXSID00589249;4-Prop-2-enoxyaniline hydrochloride;AKOS005111265;DA-01630;A1-05091;4-[(Prop-2-en-1-yl)oxy]aniline--hydrogen chloride (1/1)

Chemical Property of 4-(Allyloxy)aniline hydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 185.0607417
• Heavy Atom Count: 12
• Complexity: 117

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=CCOC1=CC=C(C=C1)N.Cl

Technology Process of 4-(Allyloxy)aniline hydrochloride

There total 2 articles about 4-(Allyloxy)aniline 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:

4-acetamidophenyl allyl ether (6622-73-7) → 4-(allyloxy)aniline hydrochloride (88271-75-4)

Guidance literature:

With hydrogenchloride; In ethanol; for 2h; Heating;

DOI:10.1021/jm00369a019

Reference yield:

4-acetaminophenol (103-90-2,8055-08-1) → 4-(allyloxy)aniline hydrochloride (88271-75-4)

Guidance literature:

Multi-step reaction with 2 steps

1: K₂CO₃ / acetone / 48 h / Heating

2: concd HCl / ethanol / 2 h / Heating

With hydrogenchloride; potassium carbonate; In ethanol; acetone;

DOI:10.1021/jm00369a019

Reference yield: 98.0%

4-(allyloxy)aniline hydrochloride (88271-75-4) + 5‐(tert‐butyl)‐2‐hydroxy‐3‐(2‐phenylpropan‐2‐yl)benzaldehyde → 2-[(4-allyloxyphenylimino)methyl]-4-tert-butyl-6-(2-phenylpropan-2-yl)phenol (1400812-16-9)

Guidance literature:

With triethylamine; In methanol; Heating;

DOI:10.1134/S1070428012080076

upstream raw materials:

4-acetamidophenyl allyl ether

4-acetaminophenol

Downstream raw materials:

1-(4-chlorobenzyl)-1-<4-(allyloxy)phenyl>hydrazine

ethyl 1-(4-chlorobenzyl)-4-methyl-6-hydroxy-4,5-dihydro-1H-thiopyrano<2,3,4-cd>indole-2-carboxylate

Ethyl [1-(4-chlorobenzyl)-3-t-butylthio-5-allyloxyindol-2-yl]carboxylate

ethyl <1-(4-chlorobenzyl)-4-methyl-6-hydroxy-4,5-dihydro-1H-thiopyrano<2,3,4-cd>indol-2-yl>acetate

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