1-[(E)-(3-hexoxyphenyl)methyleneamino]-3-hydroxy-guanidine; 4-methylbenzenesulfonic acid

Base Information

Chemical Name:1-[(E)-(3-hexoxyphenyl)methyleneamino]-3-hydroxy-guanidine; 4-methylbenzenesulfonic acid
CAS No.:87861-81-2
Molecular Formula:C₇H₈O₃S*C₁₄H₂₂N₄O₂
Molecular Weight:450.559
Hs Code.:
DSSTox Substance ID:DTXSID20473792
NSC Number:355191

Synonyms:NSC355191;87861-81-2;DTXSID20473792;NSC-355191;1-[(E)-(3-hexoxyphenyl)methyleneamino]-3-hydroxy-guanidine;4-methylbenzenesulfonic acid;N-{Amino-[N'-(3-hexyloxy-benzylidene)-hydrazino]-methyl}-hydroxylamine compound with toluene-4-sulfonic acid

Suppliers and Price of 1-[(E)-(3-hexoxyphenyl)methyleneamino]-3-hydroxy-guanidine; 4-methylbenzenesulfonic acid

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

Total 3 raw suppliers

Chemical Property of 1-[(E)-(3-hexoxyphenyl)methyleneamino]-3-hydroxy-guanidine; 4-methylbenzenesulfonic acid

Chemical Property:

Boiling Point:461.4°Cat760mmHg
Flash Point:232.9°C
Density:g/cm³
Hydrogen Bond Donor Count:4
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:10
Exact Mass:450.19369124
Heavy Atom Count:31
Complexity:514

Purity/Quality:: 85.0-99.8% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCCCCCOC1=CC=CC(=C1)C=NN=C(N)NO.CC1=CC=C(C=C1)S(=O)(=O)O
Isomeric SMILES:CCCCCCOC1=CC=CC(=C1)/C=N/N=C(\N)/NO.CC1=CC=C(C=C1)S(=O)(=O)O

Technology Process of 1-[(E)-(3-hexoxyphenyl)methyleneamino]-3-hydroxy-guanidine; 4-methylbenzenesulfonic acid

There total 3 articles about 1-[(E)-(3-hexoxyphenyl)methyleneamino]-3-hydroxy-guanidine; 4-methylbenzenesulfonic acid 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: 72.48%

: 24083-09-8
3-(hexyloxy)benzaldehyde

: 36826-58-1
N-hydroxy-N'-aminoguanidine p-toluenesulphonate

: 87861-81-2
1-<<3-(hexyloxy)benzylidene>amino>-3-hydroxyguanidine tosylate

Guidance literature:: DOI:10.1021/jm00368a024

Reference yield:

: 36778-68-4
S-methylisothiosemicarbazide tosylate

: 87861-81-2
1-<<3-(hexyloxy)benzylidene>amino>-3-hydroxyguanidine tosylate

Guidance literature:: Multi-step reaction with 2 steps

1: 44.2 percent / hydroxylamine / 48 h / Ambient temperature

2: 72.48 percent

With hydroxylamine;
DOI:10.1021/jm00368a024

Reference yield:

: 80-48-8
methyl p-toluene sulfonate

: 87861-81-2
1-<<3-(hexyloxy)benzylidene>amino>-3-hydroxyguanidine tosylate

Guidance literature:: Multi-step reaction with 3 steps

1: 135 g / CH₃OH / 18 h / Heating

2: 44.2 percent / hydroxylamine / 48 h / Ambient temperature

3: 72.48 percent

With methanol; hydroxylamine;
DOI:10.1021/jm00368a024