Cas no 6486-93-7 (C.I. 58230)
C.I. 58230 structure
Product Name:C.I. 58230
C.I. 58230 Chemical and Physical Properties
Names and Identifiers
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- C.I. 58230
- 1,2,5-trihydroxyanthracene-9,10-dione
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- Inchi： 1S/C14H8O5/c15-8-3-1-2-6-10(8)12(17)7-4-5-9(16)14(19)11(7)13(6)18/h1-5,15-16,19H
- InChI Key： FMRLRBCECZNJNN-UHFFFAOYSA-N
- SMILES： OC1=C(C=CC2C(C3C(=CC=CC=3C(C=21)=O)O)=O)O
Computed Properties
- Exact Mass: 256.037
- Monoisotopic Mass: 256.037
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 3
- Hydrogen Bond Acceptor Count: 5
- Heavy Atom Count: 19
- Rotatable Bond Count: 0
- Complexity: 407
- 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: 3.4
- Topological Polar Surface Area: 94.8?2
Experimental Properties
- Density: 1.659
- Boiling Point: 467.2°C at 760 mmHg
- Flash Point: 250.5°C
- Refractive Index: 1.772
- PSA: 94.83000
- LogP: 1.57880
C.I. 58230 Related Literature
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Yaling Zhang,Chunhui Dai,Shiwei Zhou,Bin Liu Chem. Commun., 2018,54, 10092-10095
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Xiaoming Liu,Zachary D. Hood,Wangda Li,Donovan N. Leonard,Arumugam Manthiram,Miaofang Chi J. Mater. Chem. A, 2021,9, 2111-2119
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A. B. F. da Silva,K. Capelle Phys. Chem. Chem. Phys., 2009,11, 4564-4569
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Dhirendra K. Chaudhary,Pramendra Kumar,Lokendra Kumar RSC Adv., 2016,6, 94731-94738
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Yukiya Kitayama Polym. Chem., 2014,5, 2784-2792
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