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

Base Information

Chemical Name:2-amino-4-(4-methoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile
CAS No.:119825-06-8
Molecular Formula:C21H16N2O2
Molecular Weight:328.37
Hs Code.:
DSSTox Substance ID:DTXSID30384547
Nikkaji Number:J1.451.188A
ChEMBL ID:CHEMBL1276569
Mol file:119825-06-8.mol

Synonyms:2-amino-4-(4-methoxyphenyl)-4H-benzo[h]chromene-3-carbonitrile;119825-06-8;CHEMBL1276569;DTXSID30384547;WUJXZJYOTMYIOZ-UHFFFAOYSA-N;2-Amino-4-(4-methoxy-phenyl)-4H-benzo[h]chromene-3-carbonitrile;NSC805022;STL369822;AKOS000294626;AKOS016339996;CCG-115462;NSC-805022;AB00079391-01;2Z-0224;AI-031/31971001;2-Amino-4-(4-methoxyphenyl)-4H-naphtho[1,2-b]pyran-3-carbonitrile

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

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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

Chemical Property:

PSA：68.27000
LogP:4.76688
XLogP3:4.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:328.121177757
Heavy Atom Count:25
Complexity:570

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

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

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

There total 5 articles about 2-amino-4-(4-methoxyphenyl)-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: 98.0%

: 90-15-3
α-naphthol

: 123-11-5
4-methoxy-benzaldehyde

: 109-77-3
malononitrile

: 119825-06-8
2-amino-3-cyano-4-(4-methoxyphenyl)-4H-benzo[h]chromene

Guidance literature:: With tetrabutylammomium bromide; In water; for 0.0333333h; microwave irradiation;

Reference yield: 90.0%

: 90-15-3
α-naphthol

: 105-13-5
4-Methoxybenzyl alcohol

: 109-77-3
malononitrile

: 119825-06-8
2-amino-3-cyano-4-(4-methoxyphenyl)-4H-benzo[h]chromene

Guidance literature:: With ammonium cerium (IV) nitrate; 1,2-dimethyl-3-[4-(1,2-dimethyl-1H-imidazol-3-ium-3-yl)butyl]-1H-imidazol-3-ium dibromide; In neat (no solvent); at 20 ℃; for 2h; Milling; Green chemistry;
DOI:10.4067/S0717-97072017000100019