1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylic acid

Base Information

Chemical Name:1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylic acid
CAS No.:113100-42-8
Molecular Formula:C8H12N2O2
Molecular Weight:168.19300
Hs Code.:2933199090
European Community (EC) Number:856-315-6
Mol file:113100-42-8.mol

Synonyms:1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylic acid;113100-42-8;3-methyl-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid;3-methyl-1-propan-2-ylpyrazole-4-carboxylic acid;MFCD08700649;SCHEMBL574640;JOTOIXQDQQRWDI-UHFFFAOYSA-N;AKOS003672890;LS-04182;SY084657;CS-0134661;EN300-92564;P18744;1-Isopropyl-3-methyl-pyrazole-4-carboxylic acid;1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylicacid;F2169-0868;Z802540076;1-(1-methylethyl)-3-methyl-1H-pyrazole-4-carboxylic acid

Suppliers and Price of 1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylic 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

Chemenu
1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylicacid 95%+
1g
$ 487.00

American Custom Chemicals Corporation
1-ISOPROPYL-3-METHYL-1H-PYRAZOLE-4-CARBOXYLIC ACID 95.00%
5MG
$ 504.70

Total 7 raw suppliers

Chemical Property of 1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylic acid

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Boiling Point:300.723oC at 760 mmHg
Flash Point:135.673oC
PSA：55.12000
Density:1.199g/cm3
LogP:1.47060
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:168.089877630
Heavy Atom Count:12
Complexity:182

Purity/Quality:

99%, ^*data from raw suppliers

1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylicacid 95%+ ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NN(C=C1C(=O)O)C(C)C

Technology Process of 1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylic acid

There total 2 articles about 1-Isopropyl-3-methyl-1H-pyrazole-4-carboxylic 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:

: ethyl 1-isopropyl-3-methyl-1H-pyrazole-4-carboxylate

: 113100-42-8
3-methyl-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid

Guidance literature:: With water; sodium hydroxide; In ethanol;

Reference yield:

: 85290-78-4,861585-81-1
ethyl 3-methylpyrazole-4-carboxylate

: 113100-42-8
3-methyl-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1: caesium carbonate / N,N-dimethyl-formamide / 2.5 h / 100 °C

2: sodium hydroxide; water / ethanol

With water; caesium carbonate; sodium hydroxide; In ethanol; N,N-dimethyl-formamide;

Reference yield:

: 113100-42-8
3-methyl-1-(propan-2-yl)-1H-pyrazole-4-carboxylic acid

: 3-[5-[(1S)-1-aminoethyl]-1,2,4-oxadiazol-3-yl]benzonitrile

: C₁₉H₂₀N₆O₂

Guidance literature:: With benzotriazol-1-ol; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In dichloromethane; at 25 ℃; for 16h;