Cas no 62232-23-9 (2H-1-Benzopyran-3(4H)-one, 7-methoxy-2-(4-methoxyphenyl)-)
62232-23-9 structure
Product Name:2H-1-Benzopyran-3(4H)-one, 7-methoxy-2-(4-methoxyphenyl)-
CAS No:62232-23-9
MF:C17H16O4
MW:284.306545257568
CID:453329
PubChem ID:12318045
Update Time:2025-04-19
2H-1-Benzopyran-3(4H)-one, 7-methoxy-2-(4-methoxyphenyl)- Chemical and Physical Properties
Names and Identifiers
-
- 2H-1-Benzopyran-3(4H)-one, 7-methoxy-2-(4-methoxyphenyl)-
- 7-methoxy-2-(4-methoxyphenyl)-4H-chromen-3-one
- 62232-23-9
- DTXSID60488002
-
- Inchi： 1S/C17H16O4/c1-19-13-6-3-11(4-7-13)17-15(18)9-12-5-8-14(20-2)10-16(12)21-17/h3-8,10,17H,9H2,1-2H3
- InChI Key： UDGZAXTVBAHFSR-UHFFFAOYSA-N
- SMILES： O1C2C=C(C=CC=2CC(C1C1C=CC(=CC=1)OC)=O)OC
Computed Properties
- Exact Mass: 284.10488
- Monoisotopic Mass: 284.10485899g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 21
- Rotatable Bond Count: 3
- Complexity: 362
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 1
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 3
- Topological Polar Surface Area: 44.8?2
Experimental Properties
- PSA: 44.76
2H-1-Benzopyran-3(4H)-one, 7-methoxy-2-(4-methoxyphenyl)- Related Literature
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Ivor Lon?ari? Phys. Chem. Chem. Phys., 2015,17, 9436-9445
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Zhixia Liu,Tingjian Chen,Floyd E. Romesberg Chem. Sci., 2017,8, 8179-8182
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Shintaro Takata,Yoshihiro Miura Phys. Chem. Chem. Phys., 2014,16, 24784-24789
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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