2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile

Base Information

Chemical Name:2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile
CAS No.:149550-68-5
Molecular Formula:C22H18N2O3
Molecular Weight:358.39000
Hs Code.:
DSSTox Substance ID:DTXSID801156741
Nikkaji Number:J2.027.909E
ChEMBL ID:CHEMBL591374
Mol file:149550-68-5.mol

Synonyms:2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile;149550-68-5;2-Amino-4-(3,4-dimethoxyphenyl)-4H-naphtho[1,2-b]pyran-3-carbonitrile;Oprea1_795907;Oprea1_870881;CHEMBL591374;SCHEMBL8543671;DTXSID801156741;2-Amino-4-(3,4-dimethoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile;CCG-23822;MFCD01100906;STL382048;AKOS000294614;AKOS016339956;SJ000038007;12X-0920

Suppliers and Price of 2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-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

Matrix Scientific
2-Amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile
5g
$ 7343.00

Matrix Scientific
2-Amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile
1g
$ 1836.00

Matrix Scientific
2-Amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile
500mg
$ 918.00

American Custom Chemicals Corporation
2-AMINO-4-(3,4-DIMETHOXYPHENYL)-4H-BENZO[H]CHROMENE-3-CARBONITRILE 95.00%
5MG
$ 687.35

American Custom Chemicals Corporation
2-AMINO-4-(3,4-DIMETHOXYPHENYL)-4H-BENZO[H]CHROMENE-3-CARBONITRILE 95.00%
10MG
$ 679.14

American Custom Chemicals Corporation
2-AMINO-4-(3,4-DIMETHOXYPHENYL)-4H-BENZO[H]CHROMENE-3-CARBONITRILE 95.00%
1MG
$ 647.61

Total 2 raw suppliers

Chemical Property of 2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile

Chemical Property:

PSA：77.50000
LogP:4.77548
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:3
Exact Mass:358.13174244
Heavy Atom Count:27
Complexity:624

Purity/Quality:: 2-Amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:COC1=C(C=C(C=C1)C2C3=C(C4=CC=CC=C4C=C3)OC(=C2C#N)N)OC

Technology Process of 2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile

There total 2 articles about 2-amino-4-(3,4-dimethoxyphenyl)-4H-benzo[h]chromene-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: 94.0%

: 90-15-3
α-naphthol

: 120-14-9
3,4-dimethoxy-benzaldehyde

: 109-77-3
malononitrile

: 149550-68-5
2-amino-4-(3,4-dimethoxy phenyl)-4H-benzo[h]chromene-3-carbonitrile

Guidance literature:: With tetrabutyl-ammonium chloride; In neat (no solvent); at 100 ℃; for 0.5h; Green chemistry;
DOI:10.1007/s13738-012-0073-8

Reference yield:

: 149550-68-5
2-amino-4-(3,4-dimethoxy phenyl)-4H-benzo[h]chromene-3-carbonitrile

Guidance literature:

Reference yield: 93.0%

: 149550-68-5
2-amino-4-(3,4-dimethoxy phenyl)-4H-benzo[h]chromene-3-carbonitrile

: 1446242-90-5
4-(3,4-dimethoxyphenyl)-2-oxo-2H-benzo[h]chromene-3-carbonitrile

Guidance literature:: 2-amino-4-(3,4-dimethoxy phenyl)-4H-benzo[h]chromene-3-carbonitrile; With thionyl chloride; In N,N-dimethyl-formamide; at 120 ℃; for 1h;

With water; at 20 ℃;
DOI:10.1016/j.tetlet.2013.05.030