Pyrrolidine, 1-(2-(4-(3,4-dihydro-2,2-dimethyl-7-methoxy-4-phenyl-2H-1-benzopyran-3-yl)phenoxy)ethyl)-, (E)-

Base Information

Chemical Name:Pyrrolidine, 1-(2-(4-(3,4-dihydro-2,2-dimethyl-7-methoxy-4-phenyl-2H-1-benzopyran-3-yl)phenoxy)ethyl)-, (E)-
CAS No.:84394-37-6
Molecular Formula:C30H35NO3
Molecular Weight:457.6038
Hs Code.:
UNII:30B8CDZ27J

Synonyms:30B8CDZ27J;UNII-30B8CDZ27J;84394-37-6;Pyrrolidine, 1-(2-(4-(3,4-dihydro-2,2-dimethyl-7-methoxy-4-phenyl-2H-1-benzopyran-3-yl)phenoxy)ethyl)-, (E)-;BRN 6075090;1-(2-(4-(3,4-Dihydro-7-methoxy-2,2-dimethyl-4-phenyl-2H-1-benzopyran-3-yl)phenoxy)ethyl)pyrrolidine, trans-;trans-2,2-Dimethyl-3-(p-(beta-pyrrolidinoethoxy)phenyl)-4-phenyl-7-methoxychroman

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

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Chemical Property of Pyrrolidine, 1-(2-(4-(3,4-dihydro-2,2-dimethyl-7-methoxy-4-phenyl-2H-1-benzopyran-3-yl)phenoxy)ethyl)-, (E)-

Chemical Property:

Vapor Pressure:2.05E-12mmHg at 25°C
Boiling Point:556.3°Cat760mmHg
Flash Point:145.6°C
Density:1.104g/cm³
XLogP3:6.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:457.26169398
Heavy Atom Count:34
Complexity:619

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1(C(C(C2=C(O1)C=C(C=C2)OC)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCC5)C
Isomeric SMILES:CC1([C@H]([C@@H](C2=C(O1)C=C(C=C2)OC)C3=CC=CC=C3)C4=CC=C(C=C4)OCCN5CCCC5)C

Technology Process of Pyrrolidine, 1-(2-(4-(3,4-dihydro-2,2-dimethyl-7-methoxy-4-phenyl-2H-1-benzopyran-3-yl)phenoxy)ethyl)-, (E)-

There total 6 articles about Pyrrolidine, 1-(2-(4-(3,4-dihydro-2,2-dimethyl-7-methoxy-4-phenyl-2H-1-benzopyran-3-yl)phenoxy)ethyl)-, (E)- 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: 85.0%

: 84394-33-2
1-{2-[4-((3S,4R)-7-Methoxy-2,2-dimethyl-4-phenyl-chroman-3-yl)-phenoxy]-ethyl}-pyrrolidine

: 84394-37-6
trans-2,2-dimethyl-3--4-phenyl-7-methoxychroman hydrochloride

Guidance literature:: With n-butyllithium; In hexane; dimethyl sulfoxide; for 16h; Ambient temperature;
DOI:10.1021/jm00358a026

Reference yield:

: 156-38-7
4-hydroxyphenylacetate

: 84394-37-6
trans-2,2-dimethyl-3--4-phenyl-7-methoxychroman hydrochloride

Guidance literature:: Multi-step reaction with 5 steps

1: 71 percent / NEt₃ / 10 h / Heating

2: 56 percent / diethyl ether; tetrahydrofuran / 4 h / Heating

3: 76 percent / H₂ / 10percent Pd/C / methanol / 8 h / 3102.9 Torr

4: K₂CO₃ / acetone / 14 h / Heating

5: 85 percent / n-BuLi / hexane; dimethylsulfoxide / 16 h / Ambient temperature

With n-butyllithium; hydrogen; potassium carbonate; triethylamine; palladium on activated charcoal; In tetrahydrofuran; methanol; diethyl ether; hexane; dimethyl sulfoxide; acetone;
DOI:10.1021/jm00358a026

Reference yield:

: 131-57-7,897050-18-9
Benzophenone-3

: 84394-37-6
trans-2,2-dimethyl-3--4-phenyl-7-methoxychroman hydrochloride

Guidance literature:: Multi-step reaction with 5 steps

1: 71 percent / NEt₃ / 10 h / Heating

2: 56 percent / diethyl ether; tetrahydrofuran / 4 h / Heating

3: 76 percent / H₂ / 10percent Pd/C / methanol / 8 h / 3102.9 Torr

4: K₂CO₃ / acetone / 14 h / Heating

5: 85 percent / n-BuLi / hexane; dimethylsulfoxide / 16 h / Ambient temperature

With n-butyllithium; hydrogen; potassium carbonate; triethylamine; palladium on activated charcoal; In tetrahydrofuran; methanol; diethyl ether; hexane; dimethyl sulfoxide; acetone;
DOI:10.1021/jm00358a026