4-methyl-N-[(E)-(2-prop-2-enylphenyl)methylideneamino]benzenesulfonamide

Base Information

• Chemical Name: 4-methyl-N-[(E)-(2-prop-2-enylphenyl)methylideneamino]benzenesulfonamide
• CAS No.: 73774-60-4
• Molecular Formula: C17H18N2O2S
• Molecular Weight: 314.402
• NSC Number: 314073
• DSSTox Substance ID: DTXSID50429742
• Mol file: 73774-60-4.mol

Synonyms:NSC314073;73774-60-4;DTXSID50429742;NSC-314073

Chemical Property of 4-methyl-N-[(E)-(2-prop-2-enylphenyl)methylideneamino]benzenesulfonamide

Chemical Property:

• Boiling Point: 471.8°Cat760mmHg
• Flash Point: 239.1°C
• Density: 1.13g/cm³
• XLogP3: 4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 6
• Exact Mass: 314.10889899
• Heavy Atom Count: 22
• Complexity: 473

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)NN=CC2=CC=CC=C2CC=C
• Isomeric SMILES: CC1=CC=C(C=C1)S(=O)(=O)N/N=C/C2=CC=CC=C2CC=C

Technology Process of 4-methyl-N-[(E)-(2-prop-2-enylphenyl)methylideneamino]benzenesulfonamide

There total 1 articles about 4-methyl-N-[(E)-(2-prop-2-enylphenyl)methylideneamino]benzenesulfonamide 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: 95.0%

o-allylbenzaldehyde (62708-42-3) + toluene-4-sulfonic acid hydrazide (1576-35-8) → o-Allylbenzaldehyde Tosylhydrazone (73774-60-4)

Guidance literature:

In methanol; at 40 ℃; for 0.5h;

DOI:10.1021/jo01307a008

Reference yield:

o-Allylbenzaldehyde Tosylhydrazone (73774-60-4) → 4,5-Dihydro-1,4-methano-1H-2,3-benzodiazepine (73774-59-1) + 2,3,4,5-Tetrahydro-3-<(4-methylphenyl)sulfonyl>-1,4-methano-1H-2,3-benzodiazepine (73774-56-8)

Guidance literature:

With boron trifluoride diethyl etherate; In benzene; for 6h; Title compound not separated from byproducts; Ambient temperature;

DOI:10.1021/jo01307a008

Reference yield:

o-Allylbenzaldehyde Tosylhydrazone (73774-60-4) → benzo[2,3]bicyclo[3.1.0]hexane (15677-15-3,148323-54-0,148323-57-3)

Guidance literature:

Multi-step reaction with 2 steps

1: BF₃ etherate / benzene / 6 h / Ambient temperature

2: 98 percent / benzene / 5 h / 130 °C / sealed tube

With boron trifluoride diethyl etherate; In benzene;

DOI:10.1021/jo01307a008

upstream raw materials:

o-allylbenzaldehyde

toluene-4-sulfonic acid hydrazide

Downstream raw materials:

4,5-Dihydro-1,4-methano-1H-2,3-benzodiazepine

2,3,4,5-Tetrahydro-3-<(4-methylphenyl)sulfonyl>-1,4-methano-1H-2,3-benzodiazepine

benzo[2,3]bicyclo[3.1.0]hexane