Cas no 3580-77-6 (11H-Dibenzo[b,e][1,4]dioxepin-11-one)
3580-77-6 structure
Product Name:11H-Dibenzo[b,e][1,4]dioxepin-11-one
11H-Dibenzo[b,e][1,4]dioxepin-11-one Chemical and Physical Properties
Names and Identifiers
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- 11H-Dibenzo[b,e][1,4]dioxepin-11-one
- benzo[b][1,4]benzodioxepin-6-one
- 11H-Dibenzo(b,e)(1,4)dioxepin-11-one
- doi:10.14272/YCJBWNIROIXYPD-UHFFFAOYSA-N
- Dibenzo[b,e][1,4]dioxepin-11-one
- 10.14272/YCJBWNIROIXYPD-UHFFFAOYSA-N
- CHEBI:75940
- DTXSID50189334
- Q27145649
- Depsidone
- 11H-dibenzo (b,e)-1,4-dioxepine-11-one
- Benzoic acid, 2-(2-hydroxyphenoxy)-, .epsilon.-lactone
- 3580-77-6
- SCHEMBL2113335
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- Inchi: 1S/C13H8O3/c14-13-9-5-1-2-6-10(9)15-11-7-3-4-8-12(11)16-13/h1-8H
- InChI Key: YCJBWNIROIXYPD-UHFFFAOYSA-N
- SMILES: O1C2C=CC=CC=2OC(C2C=CC=CC1=2)=O
Computed Properties
- Exact Mass: 212.04734
- Monoisotopic Mass: 212.047344
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 16
- Rotatable Bond Count: 0
- Complexity: 276
- 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: 35.5
- XLogP3: 2.9
Experimental Properties
- Density: 1.306
- Boiling Point: 353.5°Cat760mmHg
- Flash Point: 147.2°C
- Refractive Index: 1.621
- PSA: 35.53
11H-Dibenzo[b,e][1,4]dioxepin-11-one Related Literature
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1. Pycnidiophorones A–D, four new cytochalasans from the wetland derived fungus Pycnidiophora dispersaChen Zhao,Gaoran Liu,Xingzhong Liu,Lan Zhang,Lin Li,Ling Liu RSC Adv. 2020 10 40384
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Sanya Sureram,Chatchai Kesornpun,Chulabhorn Mahidol,Somsak Ruchirawat,Prasat Kittakoop RSC Adv. 2013 3 1781
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Mahmud T. Morshed,Daniel Vuong,Andrew Crombie,Alastair E. Lacey,Peter Karuso,Ernest Lacey,Andrew M. Piggott Org. Biomol. Chem. 2018 16 3038
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Mahmud T. Morshed,Hang T. Nguyen,Daniel Vuong,Andrew Crombie,Ernest Lacey,Abiodun D. Ogunniyi,Stephen W. Page,Darren J. Trott,Andrew M. Piggott Org. Biomol. Chem. 2021 19 1022
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5. Depsidone synthesis. Part 16. Benzophenone–grisa-3′,5′-diene-2′,3-dione–depsidone interconversion: a new theory of depsidone biosynthesisTony Sala,Melvyn V. Sargent J. Chem. Soc. Perkin Trans. 1 1981 855
3580-77-6 (11H-Dibenzo[b,e][1,4]dioxepin-11-one) Related Products
- 2554-82-7(2-Acetoxy-3-methoxybenzoic Acid)
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- 552-94-3(Salsalate)
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- 55482-89-8(Guacetisal)
- 580-02-9(Methyl 2-Acetyloxybenzoate)
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