cis-Decahydro-2a,4a,6a,8a-tetraazacyclopent[fg]acenaphthylene

Base Information

• Chemical Name: cis-Decahydro-2a,4a,6a,8a-tetraazacyclopent[fg]acenaphthylene
• CAS No.: 79236-92-3
• Molecular Formula: C₁₀H₁₈N₄
• Molecular Weight: 194.28
• European Community (EC) Number: 676-841-8
• Nikkaji Number: J1.048.472C,J1.256.495C,J2.331.085F
• Mol file: 79236-92-3.mol

Synonyms:79236-92-3;cis-Decahydro-2a,4a,6a,8a-tetraazacyclopent[fg]acenaphthylene;2a,4a,6a,8a-Decahydrotetraazacyclopent[fg]acenaphthylene;74199-09-0;1,4,7,10-tetrazatetracyclo[5.5.2.04,13.010,14]tetradecane;cis-Glyoxal-cyclen;decahydro-2a,4a,6a,8a-tetraazacyclopenta[fg]acenaphthylene;SCHEMBL2431350;SCHEMBL3203996;SCHEMBL5531114;YSPZOYMEWUTYDA-UHFFFAOYSA-N;CIS-DECAHYDRO-2A,4A,6A,8A-TETRAAZACYCLOPENT[FG]ACENA;MFCD05663695;AKOS017342853;AKOS025396829;1,4,7,10-tetraazatetracyclo-[5,5,2,04,13,010,14] tetradecane;1,4,7,10-tetraazatetracyclo-[5,5,2,04.13,010.14]tetradecane;1,4,7,10-tetraazatetracyclo-[5,5,2,04,13,010,14 ] tetradecane

Chemical Property of cis-Decahydro-2a,4a,6a,8a-tetraazacyclopent[fg]acenaphthylene

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 29-31°C
• Refractive Index: 1.685
• Boiling Point: 333.049°C at 760 mmHg
• Flash Point: 145.283°C
• PSA: 12.96000
• Density: 1.327g/cm³
• LogP: -1.34740
• Sensitive.: Hygroscopic
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 194.153146591
• Heavy Atom Count: 14
• Complexity: 207

Purity/Quality:

99% ^*data from raw suppliers

DECAHYDRO-CIS-2A,4A,6A,8A TETRAAZACYCLOPENT[FG]ACENAPHTHYLENE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CN2CCN3CCN4C3C2N1CC4

Technology Process of cis-Decahydro-2a,4a,6a,8a-tetraazacyclopent[fg]acenaphthylene

There total 20 articles about cis-Decahydro-2a,4a,6a,8a-tetraazacyclopent[fg]acenaphthylene 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: 100.0%

C10H16N4(2+)*2Br(1-) → cyclen-glyoxal (74199-09-0,79236-92-3)

Guidance literature:

With sodium tetrahydroborate; In ethanol; for 2h; Heating;

DOI:10.1021/jo016111d

Reference yield: 99.0%

glyoxal trimer dihydrate (4405-13-4) + 1,4,7,10-tetraazacyclododecan (294-90-6) → cyclen-glyoxal (74199-09-0,79236-92-3)

Guidance literature:

In methanol; at 0 ℃; for 3h;

DOI:10.1016/j.tet.2012.03.110

Reference yield: 98.0%

Glyoxal (131543-46-9,107-22-2) + 1,4,7,10-tetraazacyclododecan (294-90-6) → cyclen-glyoxal (74199-09-0,79236-92-3)

Guidance literature:

In methanol; water; at 20 ℃;

upstream raw materials:

Glyoxal

1,4,7,10-tetraazacyclododecan

1,4,7,10-tetraazacyclododecane tetrahydrochloride

ethylene dibromide

Downstream raw materials:

C₃₉H₅₉N₅O₅

decahydropyrazino[2,3-b]pyrazine

(7-tert-butoxycarbonylmethyl-1,4,7,10-tetraaza-cyclododec-1-yl)-acetic acid tert-butyl ester

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