2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile

Base Information

Chemical Name:2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile
CAS No.:21392-51-8
Molecular Formula:C7H9N3
Molecular Weight:135.17
Hs Code.:2933990090
European Community (EC) Number:672-210-6
DSSTox Substance ID:DTXSID50373352
Nikkaji Number:J1.375.432B
Wikidata:Q72435067
Mol file:21392-51-8.mol

Synonyms:2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile;21392-51-8;2-Amino-3-cyano-4,5-dimethylpyrrole;MFCD00849263;2-amino-3-cyano-4,5-dimethyl-1h-pyrrole;2-amino-4,5-dimethylpyrrole-3-carbonitrile;SCHEMBL6126018;DTXSID50373352;QZVLATXNNPVXEJ-UHFFFAOYSA-N;STK374329;AKOS005070062;AC-6689;SB62082;A4610;AM20090189;CS-0153597;FT-0650462;2-amino-4,5-dimethyl-1H-pyrrol-3-yl cyanide;EN300-124560;2-amino-3-cyano-4,5-dimethylpyrrole, AldrichCPR;2W-0265;W-206624

Suppliers and Price of 2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile

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
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile
500mg
$ 75.00

SynQuest Laboratories
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile
1 g
$ 16.00

SynQuest Laboratories
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile
5 g
$ 31.00

Matrix Scientific
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile >95%
5g
$ 346.00

Matrix Scientific
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile >95%
500mg
$ 118.00

Matrix Scientific
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile >95%
1g
$ 151.00

Crysdot
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile 95+%
25g
$ 138.00

Chemenu
2-Amino-4,5-dimethylpyrrole-3-carbonitrile 95%
25g
$ 116.00

Biosynth Carbosynth
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile
100 g
$ 400.00

Biosynth Carbosynth
2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile
250 g
$ 800.00

Total 49 raw suppliers

Chemical Property of 2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile

Chemical Property:

Vapor Pressure:1.49E-05mmHg at 25°C
Melting Point:178-181 °C
Refractive Index:1.575
Boiling Point:366.2 °C at 760 mmHg
PKA:18.46±0.50(Predicted)
Flash Point:175.3 °C
PSA：65.60000
Density:1.17 g/cm³
LogP:1.66658
Storage Temp.:under inert gas (nitrogen or Argon) at 2–8 °C
XLogP3:1.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:0
Exact Mass:135.079647300
Heavy Atom Count:10
Complexity:169

Purity/Quality:

97% ^*data from raw suppliers

2-Amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s): Xi
Hazard Codes:Xi,Xn
Statements: 20/21/22-41-37/38-22
Safety Statements: 26-36/37/39-39

MSDS Files:

Useful:

Canonical SMILES:CC1=C(NC(=C1C#N)N)C

Technology Process of 2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile

There total 3 articles about 2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile 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: 78.0%

: 6628-81-5,142924-42-3
2-acetamido-3-butanone

: 109-77-3
malononitrile

: 21392-51-8
2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile

Guidance literature:: With sodium hydroxide; In methanol; 1.) 0 deg C, 15 min, pH 10, 2.) 60-65 deg C, 30 min, pH 9-10;

Reference yield: 66.0%

: 56-41-7,25191-17-7,18875-37-1
L-alanin

: 108-24-7
acetic anhydride

: 109-77-3
malononitrile

: 21392-51-8
2-amino-4,5-dimethyl-1H-pyrrole-3-carbonitrile

Guidance literature:: L-alanin; acetic anhydride; With dmap; acetic acid; triethylamine; at 50 ℃; for 12h;

malononitrile; With sodium hydroxide; In water; at 60 ℃;
DOI:10.1002/bkcs.10212