SDZ NVI-085

Base Information

• Chemical Name: SDZ NVI-085
• CAS No.: 104195-17-7
• Molecular Formula: C₁₅H₂₁NO₂S
• Molecular Weight: 279.403
• Mol file: 104195-17-7.mol

Synonyms:2H-Naphth[2,3-b]-1,4-oxazine,3,4,4a,5,10,10a-hexahydro-6-methoxy-4-methyl-9-(methylthio)-, (4aR-trans)-;SDZ-NVI 085

Chemical Property of SDZ NVI-085

Chemical Property:

• Vapor Pressure: 3.51E-07mmHg at 25°C
• Boiling Point: 417.6°Cat760mmHg
• Flash Point: 206.3°C
• PSA: 47.00000
• Density: 1.19g/cm³
• LogP: 2.15280

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of SDZ NVI-085

There total 11 articles about SDZ NVI-085 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: 36.0%

lithium methanethiolate (35638-70-1) + (+/-)-trans-3,4,4a,5,10,10a-hexahydro-9-iodo-6-methoxy-4-methyl-2H-naphth<2,3-b>-1,4-oxazine (138053-15-3) → (+)-(4aS,10aS)-3,4,4a,5,10,10a-hexahydro-6-methoxy-4-methyl-9-(methylthio)-2H-naphth<2,3-b>-1,4-oxazine (103009-42-3) + SDZ NVI-085 (104195-17-7)

Guidance literature:

With copper(I) oxide; In dimethyl sulfoxide; at 80 ℃; for 5h;

DOI:10.1021/jm00081a008

Reference yield: 36.0%

lithium methanethiolate (35638-70-1) + (+/-)-trans-3,4,4a,5,10,10a-hexahydro-9-iodo-6-methoxy-4-methyl-2H-naphth<2,3-b>-1,4-oxazine (138053-15-3) → SDZ NVI-085 (104195-17-7) + (+)-(4aS,10aS)-3,4,4a,5,10,10a-hexahydro-6-methoxy-4-methyl-9-(methylthio)-2H-naphth<2,3-b>-1,4-oxazine hydrochloride (103009-41-2)

Guidance literature:

With copper(I) oxide; In dimethyl sulfoxide; at 80 ℃; for 5h;

DOI:10.1021/jm00081a008

Reference yield:

1,4-dihydro-5-methoxynaphthalene (36230-47-4) → SDZ NVI-085 (104195-17-7)

Guidance literature:

Multi-step reaction with 9 steps

1: 68 percent / mCPBA / CH₂Cl₂ / 15 h / Ambient temperature

2: 40 percent / NaN₃, concd. H₂SO₄ / dimethylsulfoxide / 15 h / 60 °C

3: 78 percent / H₂ / 10percent Pd/C / ethanol / 20 °C / 672.3 Torr

4: 79 percent / Et₃N / CH₂Cl₂ / 2 h / Ambient temperature

5: 92 percent / NaH, tetrabutylammonium iodide / tetrahydrofuran / 18 h / Ambient temperature

6: 76 percent / LiAlH₄ / tetrahydrofuran / 2 h / Heating

7: 88 percent / H₂ / 10percent Pd/C / methanol / 6 h / 20 °C / 672.3 Torr

8: 88 percent / Hg(OAc)2, I₂ / acetic acid / 0.25 h / 50 °C

9: 36 percent / Cu₂O / dimethylsulfoxide / 5 h / 80 °C

With copper(I) oxide; lithium aluminium tetrahydride; sodium azide; sulfuric acid; mercury(II) diacetate; hydrogen; iodine; tetra-(n-butyl)ammonium iodide; sodium hydride; triethylamine; 3-chloro-benzenecarboperoxoic acid; palladium on activated charcoal; In tetrahydrofuran; methanol; ethanol; dichloromethane; acetic acid; dimethyl sulfoxide;

DOI:10.1021/jm00081a008

upstream raw materials:

lithium methanethiolate

(+/-)-trans-3,4,4a,5,10,10a-hexahydro-9-iodo-6-methoxy-4-methyl-2H-naphth<2,3-b>-1,4-oxazine

1,4-dihydro-5-methoxynaphthalene

3-methoxy-1a,2,7,7a-tetrahydronaphtho[2,3-b]oxirene

Refernces

• 1、 -. "Naphthoxazines and their use as psychostimulating and antidepressant agents". . . Retrieved 2008/06/13.