Cas no 33079-56-0 (1,2-Cyclopentanedione,3,4,4-trimethyl-)
33079-56-0 structure
Product Name:1,2-Cyclopentanedione,3,4,4-trimethyl-
CAS No:33079-56-0
MF:C8H12O2
MW:140.179682731628
CID:311957
Update Time:2026-05-14
1,2-Cyclopentanedione,3,4,4-trimethyl- Chemical and Physical Properties
Names and Identifiers
-
- 1,2-Cyclopentanedione,3,4,4-trimethyl-
- 3,4,4-trimethylcyclopentane-1,2-dione
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- Inchi： InChI=1S/C8H12O2/c1-5-7(10)6(9)4-8(5,2)3/h5H,4H2,1-3H3
- InChI Key： YHJBEOWTWJHMFC-UHFFFAOYSA-N
- SMILES： O=C1CC(C)(C)C(C)C1=O
Computed Properties
- Exact Mass: 140.08376
- Monoisotopic Mass: 140.084
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 10
- Rotatable Bond Count: 0
- Complexity: 191
- 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
Experimental Properties
- Density: 1
- Boiling Point: 191.7°Cat760mmHg
- Flash Point: 65.8°C
- Refractive Index: 1.445
- PSA: 34.14
1,2-Cyclopentanedione,3,4,4-trimethyl- Related Literature
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Shivani Sharma,Chia-Ming Wu,Ranjit T. Koodali,N. Rajesh RSC Adv., 2016,6, 26668-26678
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L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
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Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
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Xin Fu,Qing-rong Liang,Rong-guang Luo,Yan-shu Li,Xiao-ping Xiao,Lu-lu Yu,Wen-zhe Shan,Guang-qin Fan J. Mater. Chem. B, 2019,7, 3088-3099
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Philipp Traber,Stephan Kupfer,Stefanie Gr?fe,Isabelle Baussanne,Martine Demeunynck,Jean-Marie Mouesca,Serge Gambarelli,Vincent Artero,Murielle Chavarot-Kerlidou Chem. Sci., 2018,9, 4152-4159
33079-56-0 (1,2-Cyclopentanedione,3,4,4-trimethyl-) Related Products
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