Cas no 5472-89-9 (5-Heptyl-5-methylimidazolidine-2,4-dione)
5472-89-9 structure
Product Name:5-Heptyl-5-methylimidazolidine-2,4-dione
CAS No:5472-89-9
MF:C11H20N2O2
MW:212.288702964783
CID:942741
PubChem ID:232315
Update Time:2025-04-19
5-Heptyl-5-methylimidazolidine-2,4-dione Chemical and Physical Properties
Names and Identifiers
-
- SR-01000037278
- 5-heptyl-5-methylimidazolidine-2,4-dione
- CHEMBL1865241
- Z56865780
- 5-heptyl-5-methyl-2,4-imidazolidinedione
- NSC29620
- HMS2759C10
- 5472-89-9
- NSC-29620
- EN300-04396
- SR-01000037278-1
- G37276
- SMR000393773
- CS-0219587
- MLS000737602
- 99991-59-0
- 5-heptyl-5-methyl-imidazolidine-2,4-dione
- AKOS008966809
- SCHEMBL1404434
- 5-Heptyl-5-methylimidazolidine-2,4-dione
-
- Inchi: 1S/C11H20N2O2/c1-3-4-5-6-7-8-11(2)9(14)12-10(15)13-11/h3-8H2,1-2H3,(H2,12,13,14,15)
- InChI Key: YKUGAPPICXMOIM-UHFFFAOYSA-N
- SMILES: O=C1C(C)(CCCCCCC)NC(N1)=O
Computed Properties
- Exact Mass: 212.15200
- Monoisotopic Mass: 212.152477885g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 6
- Complexity: 253
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.6
- Topological Polar Surface Area: 58.2?2
Experimental Properties
- PSA: 58.20000
- LogP: 2.60260
5-Heptyl-5-methylimidazolidine-2,4-dione Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Mark D. Allendorf,Alauddin Ahmed,Tom Autrey,Jeffrey Camp,Eun Seon Cho,Maciej Haranczyk,Abhi Karkamkar,Di-Jia Liu,Katie R. Meihaus,Iffat H. Nayyar,Roman Nazarov,Donald J. Siegel,Vitalie Stavila,Jeffrey J. Urban,Srimukh Prasad Veccham,Brandon C. Wood Energy Environ. Sci., 2018,11, 2784-2812
-
Raheleh Torabi,Hedayatollah Ghourchian,Massoud Amanlou Org. Biomol. Chem., 2016,14, 8141-8153
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Connor J. Taylor,Hikaru Seki,Friederike M. Dannheim,Mark J. Willis,Graeme Clemens,Brian A. Taylor,Thomas W. Chamberlain,Richard A. Bourne React. Chem. Eng., 2021,6, 1404-1411
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