Cas no 17624-02-1 ( )
structure
Product Name:
CAS No:17624-02-1
MF:C13H8O4
MW:228.200223922729
CID:906416
PubChem ID:5382529
Update Time:2025-04-19
Chemical and Physical Properties
Names and Identifiers
-
- 1,8-dihydroxyxanthen-9-one
- 1,8-dihydroxy-9H-xanthen-9-one
- 1,8-Dihydroxy-xanthen-9-on
- 1,8-dihydroxy-xanthen-9-one
- 1,8-Dihydroxyxanthon
- 1,8-dihydroxyxanthone
- AC1NTJPX
- CHEMBL494104
- CTK0H7231
- NSC143638
- Xanthenone-related compound
- BDBM11317
- DS-008496
- DTXSID70419281
- 17624-02-1
- NSC-143638
-
-
- Inchi： 1S/C13H8O4/c14-7-3-1-5-9-11(7)13(16)12-8(15)4-2-6-10(12)17-9/h1-6,14-15H
- InChI Key： XWPUJQLPABYIPZ-UHFFFAOYSA-N
- SMILES： O1C2C=CC=C(C=2C(C2C(=CC=CC1=2)O)=O)O
Computed Properties
- Exact Mass: 228.04224
- Monoisotopic Mass: 228.042
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 289
- 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: 66.8A^2
- XLogP3: 2.8
Experimental Properties
- Density: 1.516
- Boiling Point: 470.7°C at 760 mmHg
- Flash Point: 190.3°C
- Refractive Index: 1.717
- PSA: 66.76
- LogP: 2.35740
Related Literature
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Quan Xiang,Yiqin Chen,Zhiqin Li,Kaixi Bi,Guanhua Zhang,Huigao Duan Nanoscale, 2016,8, 19541-19550
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Robert J. Meagher,Anson V. Hatch,Ronald F. Renzi,Anup K. Singh Lab Chip, 2008,8, 2046-2053
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Inês S. Albuquerque,Hélia F. Jeremias,Miguel Chaves-Ferreira,Dijana Matak-Vinkovic,Omar Boutureira,Carlos C. Rom?o Chem. Commun., 2015,51, 3993-3996
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4. An all-solid-state imprinted polymer-based potentiometric sensor for determination of bisphenol S?Rongning Liang,Tanji Yin,Ruiqing Yao,Wei Qin RSC Adv., 2016,6, 73308-73312
-
Chandran Rajendran,Govindaswamy Satishkumar,Charlotte Lang,Eric M. Gaigneaux Catal. Sci. Technol., 2020,10, 2583-2592
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