methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate

Base Information

Chemical Name:methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate
CAS No.:25016-19-7
Molecular Formula:C₈H₁₂N₂O₂
Molecular Weight:168.195
Hs Code.:
DSSTox Substance ID:DTXSID301236205
Nikkaji Number:J3.209.437F
Mol file:25016-19-7.mol

Synonyms:methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate;25016-19-7;methyl 1,3,5-trimethylpyrazole-4-carboxylate;DTXSID301236205;MFCD06203736;AKOS009101002;AS-67855;CS-0039028;FT-0769278;W10761;methyl1,3,5-trimethyl-1H-pyrazole-4-carboxylate;1,3,5-Trimethyl-1H-pyrazole-4-carboxylic acid methyl ester

Suppliers and Price of methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate

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

TRC
methyl1,3,5-trimethylpyrazole-4-carboxylate
100mg
$ 240.00

Crysdot
Methyl1,3,5-trimethyl-1H-pyrazole-4-carboxylate 95+%
5g
$ 1563.00

Crysdot
Methyl1,3,5-trimethyl-1H-pyrazole-4-carboxylate 95+%
1g
$ 520.00

AK Scientific
methyl1,3,5-trimethylpyrazole-4-carboxylate
5g
$ 1650.80

Total 5 raw suppliers

Chemical Property of methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate

Chemical Property:

Vapor Pressure:0.061mmHg at 25°C
Boiling Point:231.904°C at 760 mmHg
PKA:1.04±0.10(Predicted)
Flash Point:94.053°C
PSA：44.12000
Density:1.132g/cm³
LogP:0.82350
XLogP3:0.9
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:168.089877630
Heavy Atom Count:12
Complexity:184

Purity/Quality:

98% ^*data from raw suppliers

methyl1,3,5-trimethylpyrazole-4-carboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(C(=NN1C)C)C(=O)OC

Technology Process of methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate

There total 3 articles about methyl 1,3,5-trimethyl-1H-pyrazole-4-carboxylate 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:

: 75-52-5
nitromethane

: C₆H₆Br₂N₂O₂

: 25016-19-7
1,3,5-trimethyl-4-pyrazolecarboxylic acid methyl ester

Guidance literature:: at 65 ℃; for 1h; Temperature;

Reference yield:

: 1572-13-0
3,5-diamino-1H-pyrazole-4-carboxylic acid methyl ester

: 25016-19-7
1,3,5-trimethyl-4-pyrazolecarboxylic acid methyl ester

Guidance literature:: Multi-step reaction with 3 steps

1.1: hydrogenchloride; phosphoric acid / water / 0.17 h / -5 °C

1.2: 2 h

1.3: 2.42 h / 0 - 60 °C

2.1: methanol / 2 h / 20 °C

3.1: 1 h / 65 °C

With hydrogenchloride; phosphoric acid; In methanol; water;

Reference yield:

: 22071-10-9
(E)-3-Amino-4,4,4-trichloro-2-cyano-but-2-enoic acid methyl ester

: 25016-19-7
1,3,5-trimethyl-4-pyrazolecarboxylic acid methyl ester

Guidance literature:: Multi-step reaction with 4 steps

1.1: hydrazine hydrate / N,N-dimethyl-formamide / 2 h / 20 - 95 °C

2.1: hydrogenchloride; phosphoric acid / water / 0.17 h / -5 °C

2.2: 2 h

2.3: 2.42 h / 0 - 60 °C

3.1: methanol / 2 h / 20 °C

4.1: 1 h / 65 °C

With hydrogenchloride; phosphoric acid; hydrazine hydrate; In methanol; water; N,N-dimethyl-formamide;