Cas no 71243-12-4 (Ethanone, 1-(2,4-dihydroxy-3-iodophenyl)-)
71243-12-4 structure
Product Name:Ethanone, 1-(2,4-dihydroxy-3-iodophenyl)-
CAS No:71243-12-4
MF:C8H7IO3
MW:278.043854951859
CID:1749043
PubChem ID:13275507
Update Time:2025-04-21
Ethanone, 1-(2,4-dihydroxy-3-iodophenyl)- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-(2,4-dihydroxy-3-iodophenyl)-
- 1-(2,4-dihydroxy-3-iodophenyl)ethan-1-one
- 4-acetyl-3-hydroxy-2-iodo-phenol
- JHTYTCIQMRHXMP-UHFFFAOYSA-N
- 71243-12-4
- DB-110797
- SCHEMBL481238
- 1-(2,4-dihydroxy-3-iodo-phenyl)-ethanone
-
- Inchi： 1S/C8H7IO3/c1-4(10)5-2-3-6(11)7(9)8(5)12/h2-3,11-12H,1H3
- InChI Key： JHTYTCIQMRHXMP-UHFFFAOYSA-N
- SMILES： IC1=C(C=CC(C(C)=O)=C1O)O
Computed Properties
- Exact Mass: 277.94351
- Monoisotopic Mass: 277.94399g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 2
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 12
- Rotatable Bond Count: 1
- Complexity: 183
- 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: 2.1
- Topological Polar Surface Area: 57.5?2
Experimental Properties
- PSA: 57.53
Ethanone, 1-(2,4-dihydroxy-3-iodophenyl)- Related Literature
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Guiying Zhang,Maosheng Cheng,Yanni Li,Keliang Liu,Lifeng Cai Chem. Commun., 2013,49, 11086-11088
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Yiding Jiao,Liqun Kang,Jasper Berry-Gair,Kit McColl,Jianwei Li,Haobo Dong,Hao Jiang,Ryan Wang,Furio Corà,Dan J. L. Brett,Ivan P. Parkin J. Mater. Chem. A, 2020,8, 22075-22082
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Thi Thu Tram Nguyen,Thanh Binh Nguyen Org. Biomol. Chem., 2021,19, 6015-6020
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Jason Wan Lab Chip, 2020,20, 4528-4538
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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