Cas no 720676-54-0 (2H-1-Benzopyran-2-one,4-ethoxy-6-methoxy-)
720676-54-0 structure
Product Name:2H-1-Benzopyran-2-one,4-ethoxy-6-methoxy-
CAS No:720676-54-0
MF:C12H12O4
MW:220.221283912659
CID:558409
PubChem ID:688960
Update Time:2025-04-19
2H-1-Benzopyran-2-one,4-ethoxy-6-methoxy- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1-Benzopyran-2-one,4-ethoxy-6-methoxy-
- 2H-1-Benzopyran-2-one,4-ethoxy-6-methoxy-(9CI)
- AKOS024283079
- 720676-54-0
- 4-ETHOXY-6-METHOXYCOUMARIN
- ST060211
- 4-ethoxy-6-methoxychromen-2-one
- 4-ethoxy-6-methoxy-2H-chromen-2-one
- FYBUBXWSAKPMFF-UHFFFAOYSA-N
-
- Inchi： 1S/C12H12O4/c1-3-15-11-7-12(13)16-10-5-4-8(14-2)6-9(10)11/h4-7H,3H2,1-2H3
- InChI Key： FYBUBXWSAKPMFF-UHFFFAOYSA-N
- SMILES： O1C(C=C(C2C=C(C=CC1=2)OC)OCC)=O
Computed Properties
- Exact Mass: 220.07356
- Monoisotopic Mass: 220.07355886g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 16
- Rotatable Bond Count: 3
- Complexity: 297
- 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: 1.9
- Topological Polar Surface Area: 44.8?2
Experimental Properties
- PSA: 44.76
2H-1-Benzopyran-2-one,4-ethoxy-6-methoxy- Related Literature
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Xu Jie,Deng Xu,Weili Wei RSC Adv., 2019,9, 29149-29153
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2. Estimation of hydrogen sulfide from crude petroleum: a unique invention using a simple chemosensor?Shampa Kundu,Prithidipa Sahoo New J. Chem., 2019,43, 12369-12374
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3. Estimating and correcting interference fringes in infrared spectra in infrared hyperspectral imagingGhazal Azarfar,Ebrahim Aboualizadeh,Nicholas M. Walter,Simona Ratti,Camilla Olivieri,Alessandra Norici,Michael Nasse,Achim Kohler,Mario Giordano Analyst, 2018,143, 4674-4683
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Vitaly Gurylev,Chung-Yi Su,Tsong-Pyng Perng Phys. Chem. Chem. Phys., 2016,18, 16033-16038
720676-54-0 (2H-1-Benzopyran-2-one,4-ethoxy-6-methoxy-) Related Products
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