1-Methyl-1H-indole-3-carbonitrile

Base Information

Chemical Name:1-Methyl-1H-indole-3-carbonitrile
CAS No.:24662-37-1
Molecular Formula:C10H8 N2
Molecular Weight:156.187
Hs Code.:2933990090
UNII:M3RSC92FMW
DSSTox Substance ID:DTXSID30367996
Nikkaji Number:J1.657.476G
Wikidata:Q82154255
ChEMBL ID:CHEMBL205035
Mol file:24662-37-1.mol

Synonyms:1-Methyl-1H-indole-3-carbonitrile;24662-37-1;1-methylindole-3-carbonitrile;1H-Indole-3-carbonitrile, 1-methyl-;3-Cyano-1-methylindole;M3RSC92FMW;CHEMBL205035;1H-Indole-3-carbonitrile,1-methyl-;UNII-M3RSC92FMW;EC-000.1709;D06FSR;F9995-1129;SCHEMBL1778037;3-Cyano(1-methyl-1H-indole);CHEMBL-205035;FBAXZPMXGBNBPE-UHFFFAOYSA-;DTXSID30367996;FBAXZPMXGBNBPE-UHFFFAOYSA-N;HMS1753J21;BDBM50182877;MFCD00466602;STK386450;AKOS001015339;AS-9400;PD179601;AM20040004;FT-0719960;1-Methyl-1H-indole-3-carbonitrile, AldrichCPR;EN300-265747;Z56790183;InChI=1/C10H8N2/c1-12-7-8(6-11)9-4-2-3-5-10(9)12/h2-5,7H,1H3

Suppliers and Price of 1-Methyl-1H-indole-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
1-Methyl-1H-indole-3-carbonitrile
50mg
$ 60.00

SynQuest Laboratories
1-Methyl-1H-indole-3-carbonitrile
1 g
$ 87.00

Sigma-Aldrich
1-Methyl-1H-indole-3-carbonitrile Aldrich
1g
$ 68.30

Crysdot
1-Methyl-1H-indole-3-carbonitrile 97%
5g
$ 304.00

Chemenu
1-Methyl-1H-indole-3-carbonitrile 95%+
5g
$ 287.00

ChemBridge Corporation
1-methyl-1H-indole-3-carbonitrile 95%
10 g
$ 224.00

Apolloscientific
1-Methyl-1H-indole-3-carbonitrile
1g
$ 79.00

American Custom Chemicals Corporation
1-METHYL-1H-INDOLE-3-CARBONITRILE 95.00%
5MG
$ 498.75

Alichem
1-Methyl-1H-indole-3-carbonitrile
5g
$ 313.14

Alfa Aesar
1-Methylindole-3-carbonitrile, 96%
5g
$ 279.00

Total 21 raw suppliers

Chemical Property of 1-Methyl-1H-indole-3-carbonitrile

Chemical Property:

Vapor Pressure:0.000198mmHg at 25°C
Melting Point:55-56℃
Boiling Point:327.8oC at 760 mmHg
Flash Point:152oC
PSA：28.72000
Density:1.09g/cm3
LogP:2.04998
XLogP3:2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:1
Rotatable Bond Count:0
Exact Mass:156.068748264
Heavy Atom Count:12
Complexity:215

Purity/Quality:

99%, ^*data from raw suppliers

1-Methyl-1H-indole-3-carbonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:T
Statements: 25-36
Safety Statements: 26-45

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CN1C=C(C2=CC=CC=C21)C#N

Technology Process of 1-Methyl-1H-indole-3-carbonitrile

There total 5 articles about 1-Methyl-1H-indole-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: 49.0%

: 557-21-1
zinc(II) cyanide

: 683229-61-0
1-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole

: 24662-37-1
1-methyl-1H-indole-3-carbonitrile

Guidance literature:: With copper(II) nitrate; In methanol; water; N,N-dimethyl-formamide; at 40 ℃; Solvent; Temperature; Catalytic behavior;
DOI:10.1039/c5sc04751j

Reference yield: 18.0%

: 603-76-9
1-methylindole

: 68-12-2,33513-42-7
N,N-dimethyl-formamide

: 19012-03-4
N-methyl-3-formylindole

: 24662-37-1
1-methyl-1H-indole-3-carbonitrile

Guidance literature:: With oxygen; tetrabutylammonium acetate; palladium diacetate; potassium carbonate; copper(ll) bromide; iron(II) chloride; at 130 ℃; for 24h; under 760.051 Torr;
DOI:10.1021/ja204063z

Reference yield:

: 603-76-9
1-methylindole

: 68-12-2,33513-42-7
N,N-dimethyl-formamide

: 19012-03-4
N-methyl-3-formylindole

: 85092-84-8
3-iodo-1-methyl-1H-indole

: 24662-37-1
1-methyl-1H-indole-3-carbonitrile

Guidance literature:: With copper(l) iodide; oxygen; trifluoroacetic acid; at 130 ℃; for 36h; under 760.051 Torr; Schlenk technique; Sealed tube;
DOI:10.1016/j.tetlet.2015.09.044