Cas no 55004-81-4 (2H-1-Benzopyran-2-one, 7-ethoxy-4-hydroxy-)
55004-81-4 structure
Product Name:2H-1-Benzopyran-2-one, 7-ethoxy-4-hydroxy-
CAS No:55004-81-4
MF:C11H10O4
MW:206.194703578949
CID:353089
PubChem ID:54716827
Update Time:2025-04-19
2H-1-Benzopyran-2-one, 7-ethoxy-4-hydroxy- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1-Benzopyran-2-one, 7-ethoxy-4-hydroxy-
- 7-ethoxy-4-hydroxychromen-2-one
- 7-ethoxy-4-hydroxycoumarin
- SCHEMBL11451978
- BPWIJZQVCZRWTJ-UHFFFAOYSA-N
- 55004-81-4
- DTXSID60716216
- 7-Ethoxy-4-hydroxy-2H-1-benzopyran-2-one
- NS00116901
-
- Inchi： 1S/C11H10O4/c1-2-14-7-3-4-8-9(12)6-11(13)15-10(8)5-7/h3-6,12H,2H2,1H3
- InChI Key： BPWIJZQVCZRWTJ-UHFFFAOYSA-N
- SMILES： O1C(C=C(C2C=CC(=CC1=2)OCC)O)=O
Computed Properties
- Exact Mass: 206.0579
- Monoisotopic Mass: 206.05790880g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 15
- Rotatable Bond Count: 2
- Complexity: 284
- 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: 1.6
- Topological Polar Surface Area: 55.8?2
Experimental Properties
- PSA: 55.76
2H-1-Benzopyran-2-one, 7-ethoxy-4-hydroxy- Related Literature
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
-
Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
-
Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
-
Tao Wang,Yangyang Liu,Yue Deng,Hongbo Fu,Jianmin Chen Environ. Sci.: Nano, 2018,5, 1821-1833
-
Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
55004-81-4 (2H-1-Benzopyran-2-one, 7-ethoxy-4-hydroxy-) Related Products
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