Cas no 6054-00-8 (2H-1-Benzopyran,3-phenyl-)
2H-1-Benzopyran,3-phenyl- structure
Product Name:2H-1-Benzopyran,3-phenyl-
2H-1-Benzopyran,3-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1-Benzopyran,3-phenyl-
- 3(2H)-isoflavene
- 3-phenyl-2H-chromene
-
- Inchi： 1S/C15H12O/c1-2-6-12(7-3-1)14-10-13-8-4-5-9-15(13)16-11-14/h1-10H,11H2
- InChI Key： CNNBJLXLTIKXGJ-UHFFFAOYSA-N
- SMILES： O1C2C=CC=CC=2C=C(C2C=CC=CC=2)C1
Computed Properties
- Exact Mass: 208.08886
- Monoisotopic Mass: 208.088815
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 1
- Heavy Atom Count: 16
- Rotatable Bond Count: 1
- Complexity: 263
- 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: 9.2
- XLogP3: 3.4
Experimental Properties
- Density: 1.139
- Boiling Point: 340.5°C at 760 mmHg
- Flash Point: 156.3°C
- Refractive Index: 1.618
- PSA: 9.23
2H-1-Benzopyran,3-phenyl- Related Literature
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Benjamin Gabriel Poulson,Kacper Szczepski,Joanna Izabela Lachowicz,Lukasz Jaremko,Abdul-Hamid Emwas,Mariusz Jaremko RSC Adv., 2020,10, 215-227
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M. T. Colomer,S. Díaz-Moreno,A. Tamayo,A. L. Ortiz J. Mater. Chem. C, 2018,6, 12643-12651
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Fuming Xiao,Mengzhu Wang,Yunxiang Lei,Wenbo Dai,Yunbing Zhou,Miaochang Liu,Wenxia Gao,Xiaobo Huang,Huayue Wu J. Mater. Chem. C, 2020,8, 17410-17416
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Kui Wu,Zhihua Yang,Shilie Pan Dalton Trans., 2015,44, 19856-19864
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Doug Ogrin,Laura H. van Poppel,Simon G. Bott,Andrew R. Barron Dalton Trans., 2004, 3689-3694
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