5,6-Dihydro-1H,4H-acenaphtho(1,8a-c)pyrrole-1,3,10(2H,10aH)-trione

Base Information

• Chemical Name: 5,6-Dihydro-1H,4H-acenaphtho(1,8a-c)pyrrole-1,3,10(2H,10aH)-trione
• CAS No.: 4756-92-7
• Molecular Formula: C14H11 N O3
• Molecular Weight: 241.246
• Hs Code.: 2933990090
• European Community (EC) Number: 225-293-4
• DSSTox Substance ID: DTXSID101204850
• Nikkaji Number: J236.366F
• Mol file: 4756-92-7.mol

Synonyms:4756-92-7;EINECS 225-293-4;5,6-Dihydro-1H,4H-acenaphtho(1,8a-c)pyrrole-1,3,10(2H,10aH)-trione;1H,4H-Acenaphtho[1,8a-c]pyrrole-1,3,10(2H,10aH)-trione, 5,6-dihydro-;3a,4,5,6-Tetrahydrosuccinimido(3,4-b)acenaphthen-10-one;3a,4,5,6-Tetrahydrosuccinimido[3,4-b]acenaphthen-10-one;5,6-dihydro-1H,4H-acenaphtho[1,8a-c]pyrrole-1,3,10(2H,10aH)-trione;SCHEMBL3085881;DTXSID101204850;7,8-dihydroacenaphthen-2(6h)-on-1,8a-dicarboximide;1-Oxo-2a,3,4,5-tetrahydroacenaphthene-2,2a-dicarbimide;1,8a(6H)-Acenaphthenedicarboximide, 7,8-dihydro-2-oxo-;9,10-Dihydro-1H,8H-acenaphtho[1,8a-c]pyrrole-1,3,4(2H,3ah)-trione;9,10-Dihydro-1H,8H-acenaphtho[1,8a-c]pyrrole-1,3,4(2H,3ah)-trione #

Chemical Property of 5,6-Dihydro-1H,4H-acenaphtho(1,8a-c)pyrrole-1,3,10(2H,10aH)-trione

Chemical Property:

• Vapor Pressure: 1.16E-11mmHg at 25°C
• Melting Point: 250-254 °C(lit.)
• Boiling Point: 538.4°Cat760mmHg
• Flash Point: 237.8°C
• PSA: 66.73000
• Density: 1.47g/cm³
• LogP: 1.00550
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 241.07389321
• Heavy Atom Count: 18
• Complexity: 472

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CC2=C3C(=CC=C2)C(=O)C4C3(C1)C(=O)NC4=O

Technology Process of 5,6-Dihydro-1H,4H-acenaphtho(1,8a-c)pyrrole-1,3,10(2H,10aH)-trione

There total 2 articles about 5,6-Dihydro-1H,4H-acenaphtho(1,8a-c)pyrrole-1,3,10(2H,10aH)-trione 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:

→ 3a,4,5,6-tetrahydrosuccinimido<3,4-b>acenaphthen-10-one (4756-92-7)

Guidance literature:

/BRN= 489463/ (IV), (HOCH2CH2)2O, Erhitzen;

Reference yield:

→ DL-cis-3a,4,5,6-Tetrahydro-succinimido<3,4-b>acenaphthen-10-on (4756-92-7,18693-24-8)

Guidance literature:

DL-cis-2,2a-Dicarboxamido-2a,3,4,5-tetrahydro-acenaphthen-1-on, H2SO4, Diethylenglykol; Ausb.: 94percent;

DOI:10.1021/jm00308a021 DOI:10.1021/jm00308a058

Reference yield: 78.0%

3a,4,5,6-tetrahydrosuccinimido<3,4-b>acenaphthen-10-one (4756-92-7) + 2-(4-nitrophenyl)ethanol (100-27-6) → 2-(4-Nitrophenethyl)-2,3,5,6,10,10a-hexahydro-1H,4H-acenaphtho[1,8a-c]pyrrole-1,3,4-trione (252960-96-6)

Guidance literature:

With di-isopropyl azodicarboxylate; triphenylphosphine; In N,N-dimethyl-formamide; at 20 ℃;

DOI:10.1039/a903141c

Downstream raw materials:

2-(4-Nitrophenethyl)-2,3,5,6,10,10a-hexahydro-1H,4H-acenaphtho[1,8a-c]pyrrole-1,3,4-trione

Benzyl 5-[2-(1,3,4-trioxo-2,3,5,6,10,10a-hexahydro-1H,4H-acenaphtho[1,8a-c]pyrrolyl)ethyl]-3-[2-(dimethylamino)ethyl]-1H-indole-2-carboxylate