Cas no 98735-75-2 (2,5-Piperazinedione,3,3,6-trimethyl-,(S)-(9CI))
98735-75-2 structure
Product Name:2,5-Piperazinedione,3,3,6-trimethyl-,(S)-(9CI)
CAS No:98735-75-2
MF:C7H12N2O2
MW:156.182381629944
CID:1002627
PubChem ID:45099452
Update Time:2025-04-20
2,5-Piperazinedione,3,3,6-trimethyl-,(S)-(9CI) Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Piperazinedione,3,3,6-trimethyl-,(S)-(9CI)
- (6S)-3,3,6-TRIMETHYLPIPERAZINE-2,5-DIONE
- DTXSID80667892
- 98735-75-2
-
- Inchi： 1S/C7H12N2O2/c1-4-5(10)9-7(2,3)6(11)8-4/h4H,1-3H3,(H,8,11)(H,9,10)/t4-/m0/s1
- InChI Key： QWLLBIAYORQXSC-BYPYZUCNSA-N
- SMILES： O=C1C(C)(C)NC([C@H](C)N1)=O
Computed Properties
- Exact Mass: 156.089877630g/mol
- Monoisotopic Mass: 156.089877630g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 211
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 1
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: -0.3
- Topological Polar Surface Area: 58.2?2
2,5-Piperazinedione,3,3,6-trimethyl-,(S)-(9CI) Related Literature
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Gang Pan,Yi-jie Bao,Jie Xu,Tao Liu,Cheng Liu,Yan-yan Qiu,Xiao-jing Shi,Hui Yu,Ting-ting Jia,Xia Yuan,Ze-ting Yuan,Yi-jun Cao RSC Adv., 2016,6, 42109-42119
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Andreas Nenning,Manuel Holzmann,Jürgen Fleig,Alexander K. Opitz Mater. Adv., 2021,2, 5422-5431
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Xinhuan Wang,Shuangfei Cai,Cui Qi Analyst, 2017,142, 2500-2506
98735-75-2 (2,5-Piperazinedione,3,3,6-trimethyl-,(S)-(9CI)) Related Products
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