Cas no 30237-07-1 (2,5-Cyclohexadiene-1,4-dione,2-(4-methylphenyl)-)
30237-07-1 structure
Product Name:2,5-Cyclohexadiene-1,4-dione,2-(4-methylphenyl)-
CAS No:30237-07-1
MF:C13H10O2
MW:198.217303752899
CID:314339
PubChem ID:121659
Update Time:2025-04-19
2,5-Cyclohexadiene-1,4-dione,2-(4-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Cyclohexadiene-1,4-dione,2-(4-methylphenyl)-
- 2-(4-methylphenyl)cyclohexa-2,5-diene-1,4-dione
- (4'-methylphenyl)-1,4-benzoquinone
- 2-(4-methylphenyl)-1,4-benzoquinone
- 2-(4-tolyl)-1,4-benzoquinone
- 2-(p-tolyl)-1,4-benzoquinone
- 2-(p-tolyl)cyclohexa-2,5-diene-1,4-dione
- 2-(p-tolyl)-p-benzoquinone
- 2-p-tolylcyclohexa-2,5-diene-1,4-dione
- AC1L3T5P
- AC1Q6I32
- ChemDiv3_002479
- HMS1480A15
- SureCN3786541
- 2-(4-Methylphenyl)-2,5-cyclohexadiene-1,4-dione
- AKOS001659422
- SCHEMBL3786541
- FT-0691245
- 30237-07-1
- EINECS 250-098-6
- 2-(4-methylphenyl)-1,4-benzo-quinone
- 2,5-Cyclohexadiene-1,4-dione, 2-(4-methylphenyl)-
- CHEMBL2252839
- NS00028882
- DTXSID1067544
- BDBM50545367
-
- Inchi： 1S/C13H10O2/c1-9-2-4-10(5-3-9)12-8-11(14)6-7-13(12)15/h2-8H,1H3
- InChI Key： RGVRHOACBLJGAW-UHFFFAOYSA-N
- SMILES： O=C1C=CC(C=C1C1C=CC(C)=CC=1)=O
Computed Properties
- Exact Mass: 198.0681
- Monoisotopic Mass: 198.068
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 15
- Rotatable Bond Count: 1
- Complexity: 342
- 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
- XLogP3: 2
- Topological Polar Surface Area: 34.1?2
Experimental Properties
- Density: 1.205
- Boiling Point: 348.1°Cat760mmHg
- Flash Point: 130.6°C
- Refractive Index: 1.601
- PSA: 34.14
- LogP: 2.08640
2,5-Cyclohexadiene-1,4-dione,2-(4-methylphenyl)- Related Literature
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Xiao Liu,Jun Xu,Yinyun Lv,Wenyu Wu,Weisheng Liu,Yu Tang Dalton Trans., 2013,42, 9840-9846
-
L. Di Michele,D. Fiocco,F. Varrato,E. Eiser,G. Foffi Soft Matter, 2014,10, 3633-3648
-
Yingbo Li,Nada Mehio,Huizhou Liu,Sheng Dai Green Chem., 2015,17, 2981-2993
-
Muniyandi Sankaralingam,So Hyun Jeon,Yong-Min Lee,Mi Sook Seo,Wonwoo Nam Dalton Trans., 2016,45, 376-383
-
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
30237-07-1 (2,5-Cyclohexadiene-1,4-dione,2-(4-methylphenyl)-) Related Products
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