Cas no 146494-40-8 (1,4-Naphthalenedione,2-hydroxy-3-[4-(2-hydroxy-1,1-dimethylethyl)cyclohexyl]-)
![1,4-Naphthalenedione,2-hydroxy-3-[4-(2-hydroxy-1,1-dimethylethyl)cyclohexyl]- structure](https://ossimg.kuujia.com/scimg/146500/146494-40-8x500.png)
146494-40-8 structure
Product Name:1,4-Naphthalenedione,2-hydroxy-3-[4-(2-hydroxy-1,1-dimethylethyl)cyclohexyl]-
CAS No:146494-40-8
MF:C20H24O4
MW:328.402166366577
CID:162791
PubChem ID:127009
Update Time:2025-04-19
1,4-Naphthalenedione,2-hydroxy-3-[4-(2-hydroxy-1,1-dimethylethyl)cyclohexyl]- Chemical and Physical Properties
Names and Identifiers
-
- 1,4-Naphthalenedione,2-hydroxy-3-[4-(2-hydroxy-1,1-dimethylethyl)cyclohexyl]-
- 4-hydroxy-3-[4-(1-hydroxy-2-methylpropan-2-yl)cyclohexyl]naphthalene-1,2-dione
- 1,4-Naphthalenedione, 2-hydroxy-3-(4-(2-hydroxy-1,1-dimethylethyl)cyclohexyl)-
- 298C80
- DTXSID50932847
- NS00117876
- 146494-40-8
-
- Inchi： 1S/C20H24O4/c1-20(2,11-21)13-9-7-12(8-10-13)16-17(22)14-5-3-4-6-15(14)18(23)19(16)24/h3-6,12-13,21-22H,7-11H2,1-2H3
- InChI Key： OUTQNLQNBMLELC-UHFFFAOYSA-N
- SMILES： OCC(C)(C)C1CCC(C2C(C(C3C=CC=CC=3C=2O)=O)=O)CC1
Computed Properties
- Exact Mass: 328.167459
- Monoisotopic Mass: 328.167459
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 24
- Rotatable Bond Count: 3
- Complexity: 552
- 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: 74.6
- XLogP3: 3.6
Experimental Properties
- Density: 1.266
- Boiling Point: 502.4°Cat760mmHg
- Flash Point: 271.7°C
- Refractive Index: 1.61
1,4-Naphthalenedione,2-hydroxy-3-[4-(2-hydroxy-1,1-dimethylethyl)cyclohexyl]- Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Joo Chuan Yeo,Kenry Lab Chip, 2016,16, 4082-4090
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Qiaoe Wang,Meiling Lian,Xiaowen Zhu,Xu Chen RSC Adv., 2021,11, 192-197
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Joseph H. Bisesi,Tara Sabo-Attwood Environ. Sci.: Nano, 2014,1, 574-583
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
146494-40-8 (1,4-Naphthalenedione,2-hydroxy-3-[4-(2-hydroxy-1,1-dimethylethyl)cyclohexyl]-) Related Products
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