Cas no 105694-45-9 (1(3H)-Isobenzofuranone, 4-iodo-)
105694-45-9 structure
Product Name:1(3H)-Isobenzofuranone, 4-iodo-
CAS No:105694-45-9
MF:C8H5IO2
MW:260.028574705124
CID:1161741
PubChem ID:13720122
Update Time:2025-04-20
1(3H)-Isobenzofuranone, 4-iodo- Chemical and Physical Properties
Names and Identifiers
-
- 1(3H)-Isobenzofuranone, 4-iodo-
- 4-Iodo-3H-isobenzofuran-1-one
- 4-iodophthalide
- 4-iodoisobenzofuran-1(3H)-one
- 105694-45-9
- 4-Iodo-1(3H)-isobenzofuranone
- DTXSID201308192
- 4-Iodo-3H-2-benzofuran-1-one
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- Inchi： 1S/C8H5IO2/c9-7-3-1-2-5-6(7)4-11-8(5)10/h1-3H,4H2
- InChI Key： LSTXAZHNTPWKCX-UHFFFAOYSA-N
- SMILES： IC1=CC=CC2C(=O)OCC=21
Computed Properties
- Exact Mass: 259.93295
- Monoisotopic Mass: 259.93343g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 2
- Heavy Atom Count: 11
- Rotatable Bond Count: 0
- Complexity: 181
- 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
- Topological Polar Surface Area: 26.3?2
Experimental Properties
- PSA: 26.3
1(3H)-Isobenzofuranone, 4-iodo- Related Literature
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Aloke Das,K. K. Mahato,Chayan K. Nandi,Tapas Chakraborty,Shridhar R. Gadre,Nikhil A. Gokhale Phys. Chem. Chem. Phys., 2002,4, 2162-2168
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M. Zeiger,N. J?ckel,P. Strubel,L. Borchardt,R. Reinhold,W. Nickel,J. Eckert,V. Presser,S. Kaskel J. Mater. Chem. A, 2015,3, 17983-17990
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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5. Excimer emission and magnetoluminescence of radical-based zinc(ii) complexes doped in host crystals?Shojiro Kimura,Tetsuro Kusamoto Chem. Commun., 2020,56, 11195-11198
105694-45-9 (1(3H)-Isobenzofuranone, 4-iodo-) Related Products
- 28418-88-4(4-Iodoisobenzofuran-1,3-dione)
- 1052647-27-4(Methyl 5-iodo-2,4-dimethylbenzoate)
- 41284-92-8(5-iodophthalide)
- 632-80-4(4,5,6,7-Tetraiodoisobenzofuran-1,3-dione)
- 102928-38-1(3-Iodo-1,2-benzenedicarboxylic Acid 1,2-Dimethyl Ester)
- 103440-55-7(Methyl 2-iodo-6-methylbenzoate)
- 52570-33-9(Methyl 3-iodo-2-methylbenzoate)
- 2098070-20-1(2-(3-(Pyridin-3-yl)-1H-pyrazol-1-yl)acetimidamide)
- 2680771-01-9(4-cyclopentyl-3-{(prop-2-en-1-yloxy)carbonylamino}butanoic acid)
- 1444113-98-7(N-(3-cyanothiolan-3-yl)-2-[(2,2,2-trifluoroethyl)sulfanyl]pyridine-4-carboxamide)
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