Cas no 93504-10-0 (2,5-Cyclohexadiene-1,4-dione,2-(3-methylphenyl)-)
93504-10-0 structure
Product Name:2,5-Cyclohexadiene-1,4-dione,2-(3-methylphenyl)-
CAS No:93504-10-0
MF:C13H10O2
MW:198.217303752899
CID:801392
PubChem ID:43826375
Update Time:2025-04-19
2,5-Cyclohexadiene-1,4-dione,2-(3-methylphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2,5-Cyclohexadiene-1,4-dione,2-(3-methylphenyl)-
- 2-(3-Methylphenyl)-1,4-benzoquinone
- 2-(3-Methylphenyl)-p-benzoquinone97
- 2-(3-methylphenyl)-p-benzoquinone
- AKOS002680339
- 93504-10-0
- 2-m-tolyl-[1,4]benzoquinone
- FT-0695490
-
- Inchi： 1S/C13H10O2/c1-9-3-2-4-10(7-9)12-8-11(14)5-6-13(12)15/h2-8H,1H3
- InChI Key： JFNWRNWSCMSBNI-UHFFFAOYSA-N
- SMILES： O=C1C=CC(C=C1C1C=CC=C(C)C=1)=O
Computed Properties
- Exact Mass: 198.068
- 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: 350
- 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
- Topological Polar Surface Area: 34.1A^2
- XLogP3: 2
Experimental Properties
- PSA: 34.14000
- LogP: 2.08640
2,5-Cyclohexadiene-1,4-dione,2-(3-methylphenyl)- Related Literature
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Maomao Hou,Fenglin Zhong,Qiu Jin,Enjiang Liu,Jie Feng,Tengyun Wang,Yue Gao RSC Adv., 2017,7, 34392-34400
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Min Kim,Jae-Joon Lee,Tengling Ye,Panagiotis E. Keivanidis,Kilwon Cho J. Mater. Chem. C, 2020,8, 1686-1696
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Manickam Bakthadoss,Tadiparthi Thirupathi Reddy,Vishal Agarwal,Duddu S. Sharada Chem. Commun., 2022,58, 1406-1409
93504-10-0 (2,5-Cyclohexadiene-1,4-dione,2-(3-methylphenyl)-) Related Products
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