Cas no 131086-97-0 (6H-Dibenzo[b,d]pyran-6-one,3,7-dihydroxy-)
131086-97-0 structure
Product Name:6H-Dibenzo[b,d]pyran-6-one,3,7-dihydroxy-
CAS No:131086-97-0
MF:C13H8O4
MW:228.200223922729
CID:228406
PubChem ID:5488049
Update Time:2025-04-19
6H-Dibenzo[b,d]pyran-6-one,3,7-dihydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 6H-Dibenzo[b,d]pyran-6-one,3,7-dihydroxy-
- 6H-Dibenzo(b,d)pyran-6-one, 3,7-dihydroxy-
- 3,7-dihydroxybenzo[c]chromen-6-one
- DTXSID10156885
- 131086-97-0
-
- Inchi: 1S/C13H8O4/c14-7-4-5-8-9-2-1-3-10(15)12(9)13(16)17-11(8)6-7/h1-6,14-15H
- InChI Key: CJXANWCSMBKJHE-UHFFFAOYSA-N
- SMILES: O1C(C2C(=CC=CC=2C2C=CC(=CC1=2)O)O)=O
Computed Properties
- Exact Mass: 228.04224
- Monoisotopic Mass: 228.042259
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 17
- Rotatable Bond Count: 0
- Complexity: 317
- 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: 66.8
- XLogP3: 2.9
Experimental Properties
- Density: 1.516
- Boiling Point: 494.2°Cat760mmHg
- Flash Point: 200.2°C
- Refractive Index: 1.717
- PSA: 66.76
6H-Dibenzo[b,d]pyran-6-one,3,7-dihydroxy- Related Literature
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Bin Han,Yasuo Shimizu,Gabriele Seguini,Celia Castro,Gérard Ben Assayag,Koji Inoue,Yasuyoshi Nagai,Sylvie Schamm-Chardon,Michele Perego RSC Adv., 2016,6, 3617-3622
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Yi Cao,Yujiao Xiahou,Lixiang Xing,Xiang Zhang,Hong Li,ChenShou Wu,Haibing Xia Nanoscale, 2020,12, 20456-20466
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Denis V. Korchagin,Elena A. Yureva,Alexander V. Akimov,Eugenii Ya. Misochko,Gennady V. Shilov,Artem D. Talantsev,Roman B. Morgunov,Alexander A. Shakin,Sergey M. Aldoshin,Boris S. Tsukerblat Dalton Trans., 2017,46, 7540-7548
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Chen-Yu Chien,Sheng-Sheng Yu Chem. Commun., 2020,56, 11949-11952
131086-97-0 (6H-Dibenzo[b,d]pyran-6-one,3,7-dihydroxy-) Related Products
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