Cas no 1155-54-0 (2,6-Piperazinedione,4,4'-(1,2-ethanediyl)bis[1-methyl-)
1155-54-0 structure
Product Name:2,6-Piperazinedione,4,4'-(1,2-ethanediyl)bis[1-methyl-
CAS No:1155-54-0
MF:C12H18N4O4
MW:282.295722484589
CID:140138
PubChem ID:97592
Update Time:2025-04-19
2,6-Piperazinedione,4,4'-(1,2-ethanediyl)bis[1-methyl- Chemical and Physical Properties
Names and Identifiers
-
- 1-methyl-4-[2-(4-methyl-3,5-dioxopiperazin-1-yl)ethyl]piperazine-2,6-dione
- ICRF 158
- 1,1'-dimethyl-4,4'-ethane-1,2-diyl-bis-piperazine-2,6-dione
- 4,4'-Ethylenebis(1-methyl-2,6-piperazinedione)
- AC1L3YU3
- AC1Q6KZ1
- SureCN3333138
- NSC134697
- DTXSID20151124
- SMR001797832
- 2,6-Piperazinedione, 4,4'-ethylenebis(1-methyl-
- 3ZEH7X12AE
- 2,6-Piperazinedione, 4,4'-(1,2-ethanediyl)bis(1-methyl-
- 2, 4,4'-ethylenebis[1-methyl-
- UNII-3ZEH7X12AE
- NSC-134697
- MLS002920236
- CHEMBL3186216
- 1155-54-0
- 2, 4,4'-(1,2-ethanediyl)bis[1-methyl-
- Q27258251
- NSC 134697
- SCHEMBL3333138
- 1,2-Bis(4-methyl-3,5-dioxopiperazin-1-YL)ethane
- 2,6-Piperazinedione, 4,4'-ethylenebis[1-methyl-
- 2,6-Piperazinedione,4,4'-(1,2-ethanediyl)bis[1-methyl-
-
- Inchi： 1S/C12H18N4O4/c1-13-9(17)5-15(6-10(13)18)3-4-16-7-11(19)14(2)12(20)8-16/h3-8H2,1-2H3
- InChI Key： OPWGVQGWPKYWOA-UHFFFAOYSA-N
- SMILES： O=C1CN(CC(N1C)=O)CCN1CC(N(C)C(C1)=O)=O
Computed Properties
- Exact Mass: 282.13294
- Monoisotopic Mass: 282.132805
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 6
- Heavy Atom Count: 20
- Rotatable Bond Count: 3
- Complexity: 386
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Surface Charge: 0
- Tautomer Count: 6
- XLogP3: -1.5
- Topological Polar Surface Area: 81.2
Experimental Properties
- Density: 1.302
- Boiling Point: 476.7°C at 760 mmHg
- Flash Point: 225.4°C
- Refractive Index: 1.544
- PSA: 81.24
- LogP: -2.66080
2,6-Piperazinedione,4,4'-(1,2-ethanediyl)bis[1-methyl- Related Literature
-
Alexey A. Nikolin,Eugenia P. Kramarova,Alexander G. Shipov,Yuri I. Baukov,Vadim V. Negrebetsky,Dmitry E. Arkhipov,Alexander A. Korlyukov,Alexey A. Lagunin,Sergey Yu. Bylikin,Alan R. Bassindale,Peter G. Taylor RSC Adv. 2016 6 75315
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