1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenylthiourea

Base Information

Chemical Name:1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenylthiourea
CAS No.:673855-17-9
Molecular Formula:C₁₂H₁₄N₄S
Molecular Weight:246.336
Hs Code.:
NSC Number:726869
DSSTox Substance ID:DTXSID40359569
Wikidata:Q82140834
Mol file:673855-17-9.mol

Synonyms:1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenylthiourea;673855-17-9;AC1LJDM9;DTXSID40359569;HMS1596O15;NSC726869;AKOS000442182;NSC-726869;N-phenyl-N'-(3,5-dimethylpyrazole-4yl)thiourea;N-Phenyl-N'(3,5-dimethyl-pyrazole-4-yl)thiourea;N-phenyl-N'-(3,5-dimethylpyrazole-4-yl)thiourea;SR-01000280479;SR-01000280479-1;1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenyl-thiourea

Suppliers and Price of 1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenylthiourea

Supply Marketing:

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

Manufacturers and distributors:

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Chemical Property of 1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenylthiourea

Chemical Property:

PSA：91.87000
LogP:3.12890
XLogP3:2.2
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:246.09391764
Heavy Atom Count:17
Complexity:265

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=NN1)C)NC(=S)NC2=CC=CC=C2

Technology Process of 1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenylthiourea

There total 4 articles about 1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenylthiourea 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: 74.0%

: 5272-86-6
4-amino-3,5-dimethyl-1H-pyrazole

: 103-72-0
phenyl isothiocyanate

: 673855-17-9
1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenyl-thiourea

Guidance literature:: In acetone; Heating;
DOI:10.1016/j.ejps.2005.05.005

Reference yield:

: 3656-05-1
3,5-dimethyl-4-(phenyldiazenyl)-1H-pyrazole

: 673855-17-9
1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenyl-thiourea

Guidance literature:: Multi-step reaction with 2 steps

1: hydrazine hydrate / ethanol / 50 °C

2: 74 percent / acetone / Heating

With hydrazine hydrate; In ethanol; acetone;
DOI:10.1016/j.ejps.2005.05.005

Reference yield:

: 123-54-6,81235-32-7
acetylacetone

: 673855-17-9
1-(3,5-dimethyl-1H-pyrazol-4-yl)-3-phenyl-thiourea

Guidance literature:: Multi-step reaction with 4 steps

1: CH₃COONa

2: hydrazine hydrate; AcOH / Heating

3: hydrazine hydrate / ethanol / 50 °C

4: 74 percent / acetone / Heating

With sodium acetate; hydrazine hydrate; acetic acid; In ethanol; acetone;
DOI:10.1016/j.ejps.2005.05.005