Cas no 4308-52-5 (2H-1-Benzopyran, 7-methoxy-3-phenyl-)
4308-52-5 structure
Product Name:2H-1-Benzopyran, 7-methoxy-3-phenyl-
CAS No:4308-52-5
MF:C16H14O2
MW:238.281164646149
CID:1515492
PubChem ID:15160788
Update Time:2025-04-21
2H-1-Benzopyran, 7-methoxy-3-phenyl- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1-Benzopyran, 7-methoxy-3-phenyl-
- Q63409522
- 4308-52-5
- 7-Methoxyisoflavene
- DTXSID801346229
- 7-METHOXYISOFLOVENE
- 3-phenyl,7-methoxy-benzopyran
- 2h-1-benzopyran,7-methoxy-3-phenyl-
-
- Inchi： 1S/C16H14O2/c1-17-15-8-7-13-9-14(11-18-16(13)10-15)12-5-3-2-4-6-12/h2-10H,11H2,1H3
- InChI Key： LSZIRYVRGHKUGG-UHFFFAOYSA-N
- SMILES： O1C2C=C(C=CC=2C=C(C2C=CC=CC=2)C1)OC
Computed Properties
- Exact Mass: 238.09942
- Monoisotopic Mass: 238.099379685g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 18
- Rotatable Bond Count: 2
- Complexity: 304
- 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: 18.5?2
Experimental Properties
- PSA: 18.46
2H-1-Benzopyran, 7-methoxy-3-phenyl- Related Literature
-
Supaporn Sawadjoon,Joseph S. M. Samec Org. Biomol. Chem., 2011,9, 2548-2554
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Yang Xu,Min Wang,Donghui Wei,Rongqiang Tian,Zheng Duan,Fran?ois Mathey Dalton Trans., 2019,48, 5523-5526
-
Rongyan Guo,Tao Li,Shuie Shi J. Mater. Chem. C, 2019,7, 5148-5154
-
Richa Sardessai,Shobhana Krishnaswamy,Mysore S. Shashidhar CrystEngComm, 2012,14, 8010-8016
-
Chengbin Yang,Hing Lun Tsang,Pui Man Lau,Ken-Tye Yong,Ho Pui Ho,Siu Kai Kong Analyst, 2017,142, 3579-3587
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