Cas no 219542-06-0 (2,4-Pyrrolidinedione,3,5-bis(2-methylpropyl)-)
219542-06-0 structure
Product Name:2,4-Pyrrolidinedione,3,5-bis(2-methylpropyl)-
CAS No:219542-06-0
MF:C12H21NO2
MW:211.30064368248
CID:243649
PubChem ID:45093235
Update Time:2025-04-19
2,4-Pyrrolidinedione,3,5-bis(2-methylpropyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,4-Pyrrolidinedione,3,5-bis(2-methylpropyl)-
- 2,4-Pyrrolidinedione, 3,5-bis(2-methylpropyl)- (9CI)
- 2,4-Pyrrolidinedione,3,5-bis(2-methylpropyl)-(9ci)
- 3,5-Diisobutylpyrrolidine-2,4-dione
- 219542-06-0
-
- Inchi： 1S/C12H21NO2/c1-7(2)5-9-11(14)10(6-8(3)4)13-12(9)15/h7-10H,5-6H2,1-4H3,(H,13,15)
- InChI Key： LHRNYUFQFHMAMM-UHFFFAOYSA-N
- SMILES： O=C1C(C(NC1CC(C)C)=O)CC(C)C
Computed Properties
- Exact Mass: 211.157
- Monoisotopic Mass: 211.157
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 4
- Complexity: 258
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 2
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- Topological Polar Surface Area: 46.2A^2
- XLogP3: 2.7
2,4-Pyrrolidinedione,3,5-bis(2-methylpropyl)- Related Literature
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Brindha J.,Balamurali M. M.,Kaushik Chanda RSC Adv., 2019,9, 34720-34734
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Albertus D. Handoko,Khoong Hong Khoo,Teck Leong Tan,Hongmei Jin,Zhi Wei Seh J. Mater. Chem. A, 2018,6, 21885-21890
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